* Citation * * A citation to * the MCM website and the relevant mechanism construction * protocols should be given in any publication using * information obtained from this source, using the following * or comparable wording: * * The chemical mechanistic * information was taken from the Master Chemical Mechanism, * MCM v3.3.1 (reference), via website: * http://mcm.york.ac.uk/ * * The reference should be: * * * For non-aromatic schemes: * * Jenkin et al., * Atmos. Environ., 31, 81, 1997 * [doi:10.1016/S1352-2310(96)00105-7] * Saunders et * al., Atmos. Chem. Phys., 3, 161, 2003 * [doi:10.5194/acp-3-161-2003] * * For aromatic * schemes: * * Jenkin et al., Atmos. Chem. Phys., * 3, 181, 2003 [doi:10.5194/acp-3-181-2003] * Bloss et * al., Atmos. Chem. Phys., 5, 641, 2005 * [doi:10.5194/acp-5-641-2005] * * For the * β-caryophyllene scheme: * * Jenkin et al., * Atmos. Chem. Phys., 12, 5275, 2012 * [doi:10.5194/acp-12-5275-2012] * * For the isoprene * scheme: * * Jenkin et al., Atmos. Chem. Phys., * 15, 11433-11459, 2015 [doi:10.5194/acp-15-11433-2015] Name Smiles Inchi InchiKey Mass Excited PeroxyRadical Synonyms A2PAN OCC(O)C(=O)OON(=O)=O InChI=1S/C3H5NO7/c5-1-2(6)3(7)10-11-4(8)9/h2,5-6H,1H2 RQFAVCUBLOXLKI-UHFFFAOYSA-N 167.0743 false false A2PANO OCC(O)C(=O)[O] InChI=1S/C3H5O4/c4-1-2(5)3(6)7/h2,4-5H,1H2 AWTWDPPYTMHRDM-UHFFFAOYSA-N 105.0694 false false A2PANOO OCC(O)C(=O)O[O] InChI=1S/C3H5O5/c4-1-2(5)3(6)8-7/h2,4-5H,1H2 MOTLMMLNNRETQJ-UHFFFAOYSA-N 121.0688 false true ACETOL CC(=O)CO InChI=1S/C3H6O2/c1-3(5)2-4/h4H,2H2,1H3 XLSMFKSTNGKWQX-UHFFFAOYSA-N 74.0785 false false 116-09-6, Hydroxyacetone, 1-hydroxypropan-2-one, Acetol, 2-Propanone, 1-hydroxy- ACLOO [O-][O+]=C(C)CO InChI=1S/C3H6O3/c1-3(2-4)6-5/h4H,2H2,1H3 BUIKYDWGTPZSOH-UHFFFAOYSA-N 90.0779 false false ACLOOA [O-][O+]=C(C)CO InChI=1S/C3H6O3/c1-3(2-4)6-5/h4H,2H2,1H3 BUIKYDWGTPZSOH-UHFFFAOYSA-N 90.0779 true false ACO2H OC(=O)C=C InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5) NIXOWILDQLNWCW-UHFFFAOYSA-N 72.0627 false false ACRYLIC ACID, 79-10-7, 9003-01-4, 2-Propenoic acid, Polyacrylate ACO3 [O]OC(=O)C=C InChI=1S/C3H3O3/c1-2-3(4)6-5/h2H,1H2 MJKZXIKOMKRHNJ-UHFFFAOYSA-N 87.0541 false true ACO3H OOC(=O)C=C InChI=1S/C3H4O3/c1-2-3(4)6-5/h2,5H,1H2 AZIQALWHRUQPHV-UHFFFAOYSA-N 88.0621 false false Peroxyacrylic acid, hydroxy acrylate ACR C=CC=O InChI=1S/C3H4O/c1-2-3-4/h2-3H,1H2 HGINCPLSRVDWNT-UHFFFAOYSA-N 56.0633 false false ACROLEIN, 107-02-8, Acrylaldehyde, 2-Propenal, prop-2-enal ACRO2 OCC(O[O])C=O InChI=1S/C3H5O4/c4-1-3(2-5)7-6/h1,3,5H,2H2 DUARMOCYMPUVME-UHFFFAOYSA-N 105.0694 false true ACRPAN C=CC(=O)OON(=O)=O InChI=1S/C3H3NO5/c1-2-3(5)8-9-4(6)7/h2H,1H2 SFKRQQJZRXQGLC-UHFFFAOYSA-N 133.0596 false false 157258-66-7, Peroxide, nitro 1-oxo-2-propenyl, DTXSID90460058, SCHEMBL7207887 ALLYLOH OCC=C InChI=1S/C3H6O/c1-2-3-4/h2,4H,1,3H2 XXROGKLTLUQVRX-UHFFFAOYSA-N 58.0791 false false ALLYL ALCOHOL, ALLYL-ALCOHOL, 107-18-6, PROP-2-EN-1-OL, 2-Propen-1-ol BIACETO CC(=O)C(=O)C[O] InChI=1S/C4H5O3/c1-3(6)4(7)2-5/h2H2,1H3 LUMNOSJRNXNDLW-UHFFFAOYSA-N 101.0807 false false 2,3-Dioxobutoxyradical BIACETO2 CC(=O)C(=O)CO[O] InChI=1S/C4H5O4/c1-3(5)4(6)2-8-7/h2H2,1H3 MCNRGTDFSJDBMZ-UHFFFAOYSA-N 117.0801 false true (2,3-Dioxobutylperoxy)radical BIACETOH CC(=O)C(=O)CO InChI=1S/C4H6O3/c1-3(6)4(7)2-5/h5H,2H2,1H3 NXIVQSJQXMAXJR-UHFFFAOYSA-N 102.0886 false false SCHEMBL4647414 BIACETOOH CC(=O)C(=O)COO InChI=1S/C4H6O4/c1-3(5)4(6)2-8-7/h7H,2H2,1H3 JYWVDPVJSGSFMT-UHFFFAOYSA-N 118.088 false false C23O3CCHO O=CCOC(=O)C(=O)C InChI=1S/C5H6O4/c1-4(7)5(8)9-3-2-6/h2H,3H2,1H3 JQZIMULKJBYVEJ-UHFFFAOYSA-N 130.0987 false false SCHEMBL2404789, acetaldehyde pyruvate C23O3CCO2H OC(=O)COC(=O)C(=O)C InChI=1S/C5H6O5/c1-3(6)5(9)10-2-4(7)8/h2H2,1H3,(H,7,8) WRKCXTWVOWDGBE-UHFFFAOYSA-N 146.0981 false false 79951-02-3, Propanoic acid, 2-oxo-, carboxymethyl ester, AKOS006384823, DTXSID40436389, SCHEMBL3049017 C23O3CCO3 [O]OC(=O)COC(=O)C(=O)C InChI=1S/C5H5O6/c1-3(6)5(8)10-2-4(7)11-9/h2H2,1H3 RNHSZTJZTWOLME-UHFFFAOYSA-N 161.0896 false true C23O3CCO3H OOC(=O)COC(=O)C(=O)C InChI=1S/C5H6O6/c1-3(6)5(8)10-2-4(7)11-9/h9H,2H2,1H3 SPYAIQASSDQEIX-UHFFFAOYSA-N 162.0975 false false C23O3CHO O=COC(=O)C(=O)C InChI=1S/C4H4O4/c1-3(6)4(7)8-2-5/h2H,1H3 RULCSXTUAHNYHJ-UHFFFAOYSA-N 116.0722 false false SCHEMBL386479, formyl pyruvate C23O3CPAN O=C(OON(=O)=O)COC(=O)C(=O)C InChI=1S/C5H5NO8/c1-3(7)5(9)12-2-4(8)13-14-6(10)11/h2H2,1H3 BCRDXKGRUUAZSU-UHFFFAOYSA-N 207.0951 false false C2H4 C=C InChI=1S/C2H4/c1-2/h1-2H2 VGGSQFUCUMXWEO-UHFFFAOYSA-N 28.0532 false false 9002-88-4, ETHYLENE, 74-85-1, Ethene, MFCD00084423 C2OHOCO2H OCC(O)C(=O)O InChI=1S/C3H6O4/c4-1-2(5)3(6)7/h2,4-5H,1H2,(H,6,7) RBNPOMFGQQGHHO-UHFFFAOYSA-N 106.0773 false false 473-81-4, (+-)-Glyceric acid, GLYCERIC ACID, 2,3-Dihydroxypropanoic acid, DL-Glyceric acid C2OHOCOOH OCC(O)C(=O)OO InChI=1S/C3H6O5/c4-1-2(5)3(6)8-7/h2,4-5,7H,1H2 GTTVGDRVLZEEEW-UHFFFAOYSA-N 122.0767 false false SCHEMBL7108236 C31CO3 O=COC=CC(=O)O[O] InChI=1S/C4H3O5/c5-3-8-2-1-4(6)9-7/h1-3H HAHJEFRDGJKTFG-UHFFFAOYSA-N 131.0636 false true C31CO3H O=COC=CC(=O)OO InChI=1S/C4H4O5/c5-3-8-2-1-4(6)9-7/h1-3,7H UINBHJNSLNWAMG-UHFFFAOYSA-N 132.0716 false false C31PAN O=COC=CC(=O)OO[N+](=O)[O-] InChI=1S/C4H3NO7/c6-3-10-2-1-4(7)11-12-5(8)9/h1-3H LJZFYDMSTQUIEL-UHFFFAOYSA-N 177.0691 false false C32OH13CO O=CC(O)C=O InChI=1S/C3H4O3/c4-1-3(6)2-5/h1-3,6H NVXLIZQNSVLKPO-UHFFFAOYSA-N 88.0621 false false 497-15-4, Hydroxypropanedial, 2-hydroxypropanedial, Reductone, Glucic acid C3DIOLO OCC(O)C[O] InChI=1S/C3H7O3/c4-1-3(6)2-5/h3-4,6H,1-2H2 WTZQFPAVRAJTMQ-UHFFFAOYSA-N 91.0859 false false C3DIOLO2 [O]OCC(O)CO InChI=1S/C3H7O4/c4-1-3(5)2-7-6/h3-5H,1-2H2 VXOVYNRFTLUSFB-UHFFFAOYSA-N 107.0853 false true C3DIOLOOH OOCC(O)CO InChI=1S/C3H8O4/c4-1-3(5)2-7-6/h3-6H,1-2H2 XSLBWJPPWWFTQY-UHFFFAOYSA-N 108.0932 false false glycerol oxide, SCHEMBL1032208, SCHEMBL1071843, SCHEMBL44010 C3H6 CC=C InChI=1S/C3H6/c1-3-2/h3H,1H2,2H3 QQONPFPTGQHPMA-UHFFFAOYSA-N 42.0797 false false PROPYLENE, 115-07-1, Propene, prop-1-ene, 1-Propene C3MCODBCO2 O=CC(=CC(=O)[O])C InChI=1S/C5H5O3/c1-4(3-6)2-5(7)8/h2-3H,1H3 NIRLTJYSJUMKJV-UHFFFAOYSA-N 113.0914 false false C3MCODBCO3 [O]OC(=O)C=C(C)C=O InChI=1S/C5H5O4/c1-4(3-6)2-5(7)9-8/h2-3H,1H3 YUWORUGIRIGPRC-UHFFFAOYSA-N 129.0908 false true C3MCODBPAN O=CC(=CC(=O)OON(=O)=O)C InChI=1S/C5H5NO6/c1-4(3-7)2-5(8)11-12-6(9)10/h2-3H,1H3 ABUKHSDGKGHQTM-UHFFFAOYSA-N 175.0963 false false C3MDIALO O=CC(C)([O])C=O InChI=1S/C4H5O3/c1-4(7,2-5)3-6/h2-3H,1H3 BVPMDQJDTQXCAG-UHFFFAOYSA-N 101.0807 false false C3MDIALO2 [O]OC(C)(C=O)C=O InChI=1S/C4H5O4/c1-4(2-5,3-6)8-7/h2-3H,1H3 IZPJVEIPSWTNBQ-UHFFFAOYSA-N 117.0801 false true C3MDIALOH O=CC(C)(O)C=O InChI=1S/C4H6O3/c1-4(7,2-5)3-6/h2-3,7H,1H3 SQHUBVCIVAIUAB-UHFFFAOYSA-N 102.0886 false false 2-Hydroxy-2-methylmalonaldehyde, 2-hydroxy-2-methylpropanedial, 2CI8VP7BPV, 90980-80-6, HMPD C3MDIALOOH OOC(C)(C=O)C=O InChI=1S/C4H6O4/c1-4(2-5,3-6)8-7/h2-3,7H,1H3 WJWKLOFSCXWKQD-UHFFFAOYSA-N 118.088 false false C42AOH O=CC(O)CON(=O)=O InChI=1S/C3H5NO5/c5-1-3(6)2-9-4(7)8/h1,3,6H,2H2 CQVFGUOZVNZZAM-UHFFFAOYSA-N 135.0755 false false C45NO3 [O-][N+](=O)OCC(=C)C InChI=1S/C4H7NO3/c1-4(2)3-8-5(6)7/h1,3H2,2H3 PIFTUOXVHZZPHE-UHFFFAOYSA-N 117.1033 false false 2-methyl-2-propenyl nitrate, SCHEMBL7757850, methallyl alcohol nitrate, nitric acid 2-methyl-prop-2-enyl ester C45O CC(=C)C[O] InChI=1S/C4H7O/c1-4(2)3-5/h1,3H2,2H3 HGUPZQDQYYRUPK-UHFFFAOYSA-N 71.0978 false false (2-Methylallyloxy)radical C45O2 CC(=C)CO[O] InChI=1S/C4H7O2/c1-4(2)3-6-5/h1,3H2,2H3 BVCGZBULERSRPE-UHFFFAOYSA-N 87.0972 false true C45OOH CC(=C)COO InChI=1S/C4H8O2/c1-4(2)3-6-5/h5H,1,3H2,2H3 FVOKXQFSNKXOLC-UHFFFAOYSA-N 88.1051 false false 2-Methyl-2-propenyl hydroperoxide C47CHO O=CC(C(C=O)(O)C)O[N+](=O)[O-] InChI=1S/C5H7NO6/c1-5(9,3-8)4(2-7)12-6(10)11/h2-4,9H,1H3 RDLCGXNJQBCIFY-UHFFFAOYSA-N 177.1122 false false C47CO3 O=CC(C(C(=O)O[O])(O)C)O[N+](=O)[O-] InChI=1S/C5H6NO8/c1-5(9,4(8)14-12)3(2-7)13-6(10)11/h2-3,9H,1H3 GZEXBDPYEMQLBC-UHFFFAOYSA-N 208.103 false true C47CO3H O=CC(C(C(=O)OO)(O)C)O[N+](=O)[O-] InChI=1S/C5H7NO8/c1-5(9,4(8)14-12)3(2-7)13-6(10)11/h2-3,9,12H,1H3 HMJAXDNPLKXZJW-UHFFFAOYSA-N 209.111 false false C47PAN O=CC(C(C(=O)OO[N+](=O)[O-])(O)C)O[N+](=O)[O-] InChI=1S/C5H6N2O10/c1-5(10,3(2-8)15-6(11)12)4(9)16-17-7(13)14/h2-3,10H,1H3 KDZTVOSXJMMLDB-UHFFFAOYSA-N 254.1085 false false C4CO2O O=CC([O])C(=O)C InChI=1S/C4H5O3/c1-3(6)4(7)2-5/h2,4H,1H3 CSIDGLIHGNETRT-UHFFFAOYSA-N 101.0807 false false C4CO2O2 [O]OC(C=O)C(=O)C InChI=1S/C4H5O4/c1-3(6)4(2-5)8-7/h2,4H,1H3 KSSGRDJNZMPOPI-UHFFFAOYSA-N 117.0801 false true C4CO2OOH OOC(C=O)C(=O)C InChI=1S/C4H6O4/c1-3(6)4(2-5)8-7/h2,4,7H,1H3 NOBUEMWCPQFCCN-UHFFFAOYSA-N 118.088 false false C4M2AL2OH O=CC(O)C(C)(O)C=O InChI=1S/C5H8O4/c1-5(9,3-7)4(8)2-6/h2-4,8-9H,1H3 NUHRTSFMSDZSTE-UHFFFAOYSA-N 132.1146 false false C4M2ALOHNO3 O=CC(O)C(C)(C=O)ON(=O)=O InChI=1S/C5H7NO6/c1-5(3-8,4(9)2-7)12-6(10)11/h2-4,9H,1H3 UOGOTHSJBRKVRR-UHFFFAOYSA-N 177.1122 false false C4M2ALOHO O=CC(O)C(C)([O])C=O InChI=1S/C5H7O4/c1-5(9,3-7)4(8)2-6/h2-4,8H,1H3 FAEOTFFIRAVMAW-UHFFFAOYSA-N 131.1067 false false C4M2ALOHO2 O=CC(O)C(C)(O[O])C=O InChI=1S/C5H7O5/c1-5(3-7,10-9)4(8)2-6/h2-4,8H,1H3 QIJWRUSDFFPUMY-UHFFFAOYSA-N 147.1061 false true C4MALOHOOH O=CC(O)C(C)(OO)C=O InChI=1S/C5H8O5/c1-5(3-7,10-9)4(8)2-6/h2-4,8-9H,1H3 NJMKFLHNNBFYIH-UHFFFAOYSA-N 148.114 false false C4MDIAL O=CC=C(C)C=O InChI=1S/C5H6O2/c1-5(4-7)2-3-6/h2-4H,1H3 USBJWIKCHJDWPF-UHFFFAOYSA-N 98.0999 false false 2-methylbut-2-ene-1,4-dial, 2-methylbutenedial C4PAN10 OCC(=O)C(O)C(=O)OON(=O)=O InChI=1S/C4H5NO8/c6-1-2(7)3(8)4(9)12-13-5(10)11/h3,6,8H,1H2 JOAGXXIRMSWAAZ-UHFFFAOYSA-N 195.0844 false false C4PAN5 O=N(=O)OOC(=O)C(C)(C)O InChI=1S/C4H7NO6/c1-4(2,7)3(6)10-11-5(8)9/h7H,1-2H3 BZGCEXLIVXRKKX-UHFFFAOYSA-N 165.1015 false false C4PAN6 O=N(=O)OOC(=O)C(O)C(=O)C InChI=1S/C4H5NO7/c1-2(6)3(7)4(8)11-12-5(9)10/h3,7H,1H3 QRAIBPAZBCTEOB-UHFFFAOYSA-N 179.085 false false C510O O=CC(O)C(C)([O])CON(=O)=O InChI=1S/C5H8NO6/c1-5(9,4(8)2-7)3-12-6(10)11/h2,4,8H,3H2,1H3 WSQDOSNUEMWIQG-UHFFFAOYSA-N 178.1201 false false C510O2 O=CC(O)C(C)(O[O])CON(=O)=O InChI=1S/C5H8NO7/c1-5(13-11,4(8)2-7)3-12-6(9)10/h2,4,8H,3H2,1H3 METATZMPYSTVQR-UHFFFAOYSA-N 194.1195 false true C510OH O=CC(O)C(C)(O)CON(=O)=O InChI=1S/C5H9NO6/c1-5(9,4(8)2-7)3-12-6(10)11/h2,4,8-9H,3H2,1H3 ZCOZZYNQPKXJEJ-UHFFFAOYSA-N 179.1281 false false C510OOH O=CC(O)C(C)(OO)CON(=O)=O InChI=1S/C5H9NO7/c1-5(13-11,4(8)2-7)3-12-6(9)10/h2,4,8,11H,3H2,1H3 GGBWELVRYZRQMP-UHFFFAOYSA-N 195.1275 false false C51NO3 OCC(CC(=O)C)ON(=O)=O InChI=1S/C5H9NO5/c1-4(8)2-5(3-7)11-6(9)10/h5,7H,2-3H2,1H3 OMTWKQRBUUWUQB-UHFFFAOYSA-N 163.1287 false false C51O CC(=O)CC([O])CO InChI=1S/C5H9O3/c1-4(7)2-5(8)3-6/h5-6H,2-3H2,1H3 ZEABMLWFHOBQHA-UHFFFAOYSA-N 117.1232 false false C51O2 OCC(O[O])CC(=O)C InChI=1S/C5H9O4/c1-4(7)2-5(3-6)9-8/h5-6H,2-3H2,1H3 NNEWVYVXHISAJW-UHFFFAOYSA-N 133.1226 false true C51OH CC(=O)CC(O)CO InChI=1S/C5H10O3/c1-4(7)2-5(8)3-6/h5-6,8H,2-3H2,1H3 NJUQBPDKVORANW-UHFFFAOYSA-N 118.1311 false false SCHEMBL689567 C51OOH OCC(OO)CC(=O)C InChI=1S/C5H10O4/c1-4(7)2-5(3-6)9-8/h5-6,8H,2-3H2,1H3 IZBMMNKBXWVQLB-UHFFFAOYSA-N 134.1305 false false C524CO OCC(=O)C(=C)CO InChI=1S/C5H8O3/c1-4(2-6)5(8)3-7/h6-7H,1-3H2 JVFYSLPFISVGRS-UHFFFAOYSA-N 116.1152 false false C524NO3 OCC(=C)C(CO)ON(=O)=O InChI=1S/C5H9NO5/c1-4(2-7)5(3-8)11-6(9)10/h5,7-8H,1-3H2 IRMGDWDXIVCKPE-UHFFFAOYSA-N 163.1287 false false C524O OCC(=C)C([O])CO InChI=1S/C5H9O3/c1-4(2-6)5(8)3-7/h5-7H,1-3H2 VITGSDKVRIHXNG-UHFFFAOYSA-N 117.1232 false false C524O2 OCC(=C)C(CO)O[O] InChI=1S/C5H9O4/c1-4(2-6)5(3-7)9-8/h5-7H,1-3H2 RJPPKSMFMYUBFK-UHFFFAOYSA-N 133.1226 false true C524OH OCC(=C)C(O)CO InChI=1S/C5H10O3/c1-4(2-6)5(8)3-7/h5-8H,1-3H2 PGARYUHLQUORKU-UHFFFAOYSA-N 118.1311 false false 2-methylene-butane-1,3,4-triol, SCHEMBL4854238 C524OOH OCC(=C)C(CO)OO InChI=1S/C5H10O4/c1-4(2-6)5(3-7)9-8/h5-8H,1-3H2 CMYVSBWTXHBCDK-UHFFFAOYSA-N 134.1305 false false C525O OCC(=O)C([O])(CO)CO InChI=1S/C5H9O5/c6-1-4(9)5(10,2-7)3-8/h6-8H,1-3H2 VHRNUDQMKJFGGH-UHFFFAOYSA-N 149.122 false false C525O2 OCC(=O)C(CO)(CO)O[O] InChI=1S/C5H9O6/c6-1-4(9)5(2-7,3-8)11-10/h6-8H,1-3H2 DABDXWHCKTYOKJ-UHFFFAOYSA-N 165.1214 false true C525OOH OCC(=O)C(CO)(CO)OO InChI=1S/C5H10O6/c6-1-4(9)5(2-7,3-8)11-10/h6-8,10H,1-3H2 KYXSOONCNSTMJK-UHFFFAOYSA-N 166.1293 false false C526NO3 OCC(C(O[N+](=O)[O-])(C=O)C)OO InChI=1S/C5H9NO7/c1-5(3-8,13-6(9)10)4(2-7)12-11/h3-4,7,11H,2H2,1H3 RZAQFCZGDSACHS-UHFFFAOYSA-N 195.1275 false false C526O OCC(C(C=O)([O])C)OO InChI=1S/C5H9O5/c1-5(8,3-7)4(2-6)10-9/h3-4,6,9H,2H2,1H3 PWCGJDDTJKWSFN-UHFFFAOYSA-N 149.122 false false C526O2 OCC(C(C=O)(O[O])C)OO InChI=1S/C5H9O6/c1-5(3-7,11-9)4(2-6)10-8/h3-4,6,8H,2H2,1H3 PYZJGTXDCQNSOF-UHFFFAOYSA-N 165.1214 false true C526OOH OCC(C(C=O)(OO)C)OO InChI=1S/C5H10O6/c1-5(3-7,11-9)4(2-6)10-8/h3-4,6,8-9H,2H2,1H3 MGAXMSAMPDOIEA-UHFFFAOYSA-N 166.1293 false false C527NO3 O=CC(C(OO)(CO)C)O[N+](=O)[O-] InChI=1S/C5H9NO7/c1-5(3-8,13-11)4(2-7)12-6(9)10/h2,4,8,11H,3H2,1H3 LONQPYNLXMNIQC-UHFFFAOYSA-N 195.1275 false false C527O O=CC(C(OO)(CO)C)[O] InChI=1S/C5H9O5/c1-5(3-7,10-9)4(8)2-6/h2,4,7,9H,3H2,1H3 WMAVBTZSCBSCGG-UHFFFAOYSA-N 149.122 false false C527O2 [O]OC(C(OO)(CO)C)C=O InChI=1S/C5H9O6/c1-5(3-7,11-9)4(2-6)10-8/h2,4,7,9H,3H2,1H3 NVMXFEYRKHYEJC-UHFFFAOYSA-N 165.1214 false true C527OOH OOC(C(OO)(CO)C)C=O InChI=1S/C5H10O6/c1-5(3-7,11-9)4(2-6)10-8/h2,4,7-9H,3H2,1H3 TVSMEXDFNUIAEG-UHFFFAOYSA-N 166.1293 false false C530NO3 O=CCC(O[N+](=O)[O-])(CO)C InChI=1S/C5H9NO5/c1-5(4-8,2-3-7)11-6(9)10/h3,8H,2,4H2,1H3 LOQWBFJDONNJMS-UHFFFAOYSA-N 163.1287 false false C530O CC(CO)(CC=O)[O] InChI=1S/C5H9O3/c1-5(8,4-7)2-3-6/h3,7H,2,4H2,1H3 XONPOEMDWFYZSB-UHFFFAOYSA-N 117.1232 false false C530O2 O=CCC(O[O])(CO)C InChI=1S/C5H9O4/c1-5(4-7,9-8)2-3-6/h3,7H,2,4H2,1H3 VROSJLLLYSPKCN-UHFFFAOYSA-N 133.1226 false true C530OOH O=CCC(OO)(CO)C InChI=1S/C5H10O4/c1-5(4-7,9-8)2-3-6/h3,7-8H,2,4H2,1H3 SDSILMYIZYVNOQ-UHFFFAOYSA-N 134.1305 false false C531CO O=COC=CC(=O)C=O InChI=1S/C5H4O4/c6-3-5(8)1-2-9-4-7/h1-4H GEPCQGXXXAQMFT-UHFFFAOYSA-N 128.0829 false false C531O O=COC=CC(=O)C[O] InChI=1S/C5H5O4/c6-3-5(8)1-2-9-4-7/h1-2,4H,3H2 MDHMLTRGRANXFR-UHFFFAOYSA-N 129.0908 false false C531O2 [O]OCC(=O)C=COC=O InChI=1S/C5H5O5/c6-4-9-2-1-5(7)3-10-8/h1-2,4H,3H2 QBSIPXIZSBYIGU-UHFFFAOYSA-N 145.0902 false true C531OOH OOCC(=O)C=COC=O InChI=1S/C5H6O5/c6-4-9-2-1-5(7)3-10-8/h1-2,4,8H,3H2 DGDWSVJHSAIHNR-UHFFFAOYSA-N 146.0981 false false C532CO O=COC=CC(=O)C InChI=1S/C5H6O3/c1-5(7)2-3-8-4-6/h2-4H,1H3 YSKLKQHTFBFDNG-UHFFFAOYSA-N 114.0993 false false C533O O=COC(C(C(=O)C)[O])O InChI=1S/C5H7O5/c1-3(7)4(8)5(9)10-2-6/h2,4-5,9H,1H3 LWEVATGUAJPYPT-UHFFFAOYSA-N 147.1061 false false C533O2 O=COC(C(C(=O)C)O[O])O InChI=1S/C5H7O6/c1-3(7)4(11-9)5(8)10-2-6/h2,4-5,8H,1H3 SJOORTKBCGPHNP-UHFFFAOYSA-N 163.1055 false true C533OOH O=COC(C(C(=O)C)OO)O InChI=1S/C5H8O6/c1-3(7)4(11-9)5(8)10-2-6/h2,4-5,8-9H,1H3 HIRATINEIXKQAC-UHFFFAOYSA-N 164.1134 false false C534O CC(C(=O)OO)(C(C=O)O)[O] InChI=1S/C5H7O6/c1-5(9,3(7)2-6)4(8)11-10/h2-3,7,10H,1H3 WREZFMYWXUXNNI-UHFFFAOYSA-N 163.1055 false false C534O2 O=CC(C(C(=O)OO)(O[O])C)O InChI=1S/C5H7O7/c1-5(12-10,3(7)2-6)4(8)11-9/h2-3,7,9H,1H3 DVLWBJFJZJXSRF-UHFFFAOYSA-N 179.1049 false true C534OOH O=CC(C(C(=O)OO)(OO)C)O InChI=1S/C5H8O7/c1-5(12-10,3(7)2-6)4(8)11-9/h2-3,7,9-10H,1H3 OZJUTJGGLIZENX-UHFFFAOYSA-N 180.1128 false false C535O CC(C(C(=O)OO)O)(C=O)[O] InChI=1S/C5H7O6/c1-5(9,2-6)3(7)4(8)11-10/h2-3,7,10H,1H3 GLMFATIJDCEQDF-UHFFFAOYSA-N 163.1055 false false C535O2 OOC(=O)C(C(C=O)(O[O])C)O InChI=1S/C5H7O7/c1-5(2-6,12-10)3(7)4(8)11-9/h2-3,7,9H,1H3 JZYVYMOCLUUYMU-UHFFFAOYSA-N 179.1049 false true C535OOH OOC(=O)C(C(C=O)(OO)C)O InChI=1S/C5H8O7/c1-5(2-6,12-10)3(7)4(8)11-9/h2-3,7,9-10H,1H3 OMSPQDTYZAZBBN-UHFFFAOYSA-N 180.1128 false false C536O OOCC(C(C=O)([O])C)OO InChI=1S/C5H9O6/c1-5(7,3-6)4(11-9)2-10-8/h3-4,8-9H,2H2,1H3 AMHWUPAMOBBSHX-UHFFFAOYSA-N 165.0399 false false C536O2 OOCC(C(C=O)(O[O])C)OO InChI=1S/C5H9O7/c1-5(3-6,12-9)4(11-8)2-10-7/h3-4,7-8H,2H2,1H3 ROQXQROUUJCLBC-UHFFFAOYSA-N 181.0348 false true C536OOH OOCC(C(C=O)(OO)C)OO InChI=1S/C5H10O7/c1-5(3-6,12-9)4(11-8)2-10-7/h3-4,7-9H,2H2,1H3 XYVQSBFINMKQQB-UHFFFAOYSA-N 182.0426 false false C537O OOCC(C(C=O)[O])(OO)C InChI=1S/C5H9O6/c1-5(11-9,3-10-8)4(7)2-6/h2,4,8-9H,3H2,1H3 YSHLIPHNCMUZOY-UHFFFAOYSA-N 165.0399 false false C537O2 OOCC(C(C=O)O[O])(OO)C InChI=1S/C5H9O7/c1-5(12-9,3-10-7)4(2-6)11-8/h2,4,7,9H,3H2,1H3 XJCPHGZNSZWFTG-UHFFFAOYSA-N 181.0348 false true C537OOH OOCC(C(C=O)OO)(OO)C InChI=1S/C5H10O7/c1-5(12-9,3-10-7)4(2-6)11-8/h2,4,7-9H,3H2,1H3 DSODWLIZYVEJOG-UHFFFAOYSA-N 182.0426 false false C57AO OCC(C(C=O)(O)C)[O] InChI=1S/C5H9O4/c1-5(9,3-7)4(8)2-6/h3-4,6,9H,2H2,1H3 MQYJNLPTUMTBSI-UHFFFAOYSA-N 133.1226 false false C57AO2 OCC(C(C=O)(O)C)O[O] InChI=1S/C5H9O5/c1-5(8,3-7)4(2-6)10-9/h3-4,6,8H,2H2,1H3 QHIRWHSIZVUCOA-UHFFFAOYSA-N 149.122 false true C57AOOH OCC(C(C=O)(O)C)OO InChI=1S/C5H10O5/c1-5(8,3-7)4(2-6)10-9/h3-4,6,8-9H,2H2,1H3 FXRPDHRZJDYXTP-UHFFFAOYSA-N 150.1299 false false C57NO3 OCC(O)C(C)(C=O)ON(=O)=O InChI=1S/C5H9NO6/c1-5(3-8,4(9)2-7)12-6(10)11/h3-4,7,9H,2H2,1H3 KHAJTJUOMDNQGW-UHFFFAOYSA-N 179.1281 false false C57NO3CO2H OCC(O)C(C)(ON(=O)=O)C(=O)O InChI=1S/C5H9NO7/c1-5(4(9)10,3(8)2-7)13-6(11)12/h3,7-8H,2H2,1H3,(H,9,10) VNPCVOYEGJTTSH-UHFFFAOYSA-N 195.1275 false false C57NO3CO3 OCC(O)C(C)(ON(=O)=O)C(=O)O[O] InChI=1S/C5H8NO8/c1-5(3(8)2-7,4(9)13-12)14-6(10)11/h3,7-8H,2H2,1H3 IQKANEVOHRTEPG-UHFFFAOYSA-N 210.1189 false true C57NO3CO3H OCC(O)C(C)(ON(=O)=O)C(=O)OO InChI=1S/C5H9NO8/c1-5(3(8)2-7,4(9)13-12)14-6(10)11/h3,7-8,12H,2H2,1H3 BPRAPKBGVRGZEK-UHFFFAOYSA-N 211.1269 false false C57NO3PAN OCC(O)C(C)(ON(=O)=O)C(=O)OON(=O)=O InChI=1S/C5H8N2O10/c1-5(3(9)2-8,16-6(11)12)4(10)15-17-7(13)14/h3,8-9H,2H2,1H3 QHZGCLHPLOENFL-UHFFFAOYSA-N 256.1244 false false C57O OCC(O)C(C)([O])C=O InChI=1S/C5H9O4/c1-5(9,3-7)4(8)2-6/h3-4,6,8H,2H2,1H3 IOWXFKOCRDKZMO-UHFFFAOYSA-N 133.1226 false false C57O2 OCC(O)C(C)(O[O])C=O InChI=1S/C5H9O5/c1-5(3-7,10-9)4(8)2-6/h3-4,6,8H,2H2,1H3 PLECCGUGRAAFBS-UHFFFAOYSA-N 149.122 false true C57OH OCC(O)C(C)(O)C=O InChI=1S/C5H10O4/c1-5(9,3-7)4(8)2-6/h3-4,6,8-9H,2H2,1H3 ZKDSJDSEVDWBAC-UHFFFAOYSA-N 134.1305 false false SCHEMBL8135361 C57OOH OCC(O)C(C)(OO)C=O InChI=1S/C5H10O5/c1-5(3-7,10-9)4(8)2-6/h3-4,6,8-9H,2H2,1H3 VJGRRPOTERGJKF-UHFFFAOYSA-N 150.1299 false false C58ANO3 [O-][N+](=O)OC(C(CO)(O)C)C=O InChI=1S/C5H9NO6/c1-5(9,3-8)4(2-7)12-6(10)11/h2,4,8-9H,3H2,1H3 CKOYBJYGRVJEJQ-UHFFFAOYSA-N 179.1281 false false C58AO O=CC([O])C(C)(O)CO InChI=1S/C5H9O4/c1-5(9,3-7)4(8)2-6/h2,4,7,9H,3H2,1H3 RPJQTQHWWNTGQR-UHFFFAOYSA-N 133.1226 false false C58AO2 [O]OC(C(CO)(O)C)C=O InChI=1S/C5H9O5/c1-5(8,3-7)4(2-6)10-9/h2,4,7-8H,3H2,1H3 WJBOZRWMTPBFJC-UHFFFAOYSA-N 149.122 false true C58AOOH OOC(C=O)C(C)(O)CO InChI=1S/C5H10O5/c1-5(8,3-7)4(2-6)10-9/h2,4,7-9H,3H2,1H3 MCOKLECUTPXNOW-UHFFFAOYSA-N 150.1299 false false C58NO3 O=CC(O)C(C)(CO)ON(=O)=O InChI=1S/C5H9NO6/c1-5(3-8,4(9)2-7)12-6(10)11/h2,4,8-9H,3H2,1H3 UZUIBKBJXOKLGO-UHFFFAOYSA-N 179.1281 false false C58NO3CO2H OCC(C)(ON(=O)=O)C(O)C(=O)O InChI=1S/C5H9NO7/c1-5(2-7,13-6(11)12)3(8)4(9)10/h3,7-8H,2H2,1H3,(H,9,10) QOEJXJLKIMUJIJ-UHFFFAOYSA-N 195.1275 false false C58NO3CO3 [O]OC(=O)C(O)C(C)(CO)ON(=O)=O InChI=1S/C5H8NO8/c1-5(2-7,14-6(10)11)3(8)4(9)13-12/h3,7-8H,2H2,1H3 AYEVMLSEEBBXBJ-UHFFFAOYSA-N 210.1189 false true C58NO3CO3H OOC(=O)C(O)C(C)(CO)ON(=O)=O InChI=1S/C5H9NO8/c1-5(2-7,14-6(10)11)3(8)4(9)13-12/h3,7-8,12H,2H2,1H3 NFQMHUFQLLKQQS-UHFFFAOYSA-N 211.1269 false false C58NO3PAN OCC(C)(ON(=O)=O)C(O)C(=O)OON(=O)=O InChI=1S/C5H8N2O10/c1-5(2-8,16-6(11)12)3(9)4(10)15-17-7(13)14/h3,8-9H,2H2,1H3 VIMTZSSJOGPGII-UHFFFAOYSA-N 256.1244 false false C58O O=CC(O)C(C)([O])CO InChI=1S/C5H9O4/c1-5(9,3-7)4(8)2-6/h2,4,7-8H,3H2,1H3 LUVCPWIWTSJPAY-UHFFFAOYSA-N 133.1226 false false C58O2 O=CC(O)C(C)(CO)O[O] InChI=1S/C5H9O5/c1-5(3-7,10-9)4(8)2-6/h2,4,7-8H,3H2,1H3 IRVFEQIBFSTCSK-UHFFFAOYSA-N 149.122 false true C58OH O=CC(O)C(C)(O)CO InChI=1S/C5H10O4/c1-5(9,3-7)4(8)2-6/h2,4,7-9H,3H2,1H3 HTPZSALIZDTBIL-UHFFFAOYSA-N 134.1305 false false 3-Methyl-2,3,4-trihydroxybutanal C58OOH O=CC(O)C(C)(CO)OO InChI=1S/C5H10O5/c1-5(3-7,10-9)4(8)2-6/h2,4,7-9H,3H2,1H3 MTCQYLXAFMKVMT-UHFFFAOYSA-N 150.1299 false false C59O OCC(=O)C(C)([O])CO InChI=1S/C5H9O4/c1-5(9,3-7)4(8)2-6/h6-7H,2-3H2,1H3 JGXOIUKXSJSDQJ-UHFFFAOYSA-N 133.1226 false false C59O2 OCC(=O)C(C)(CO)O[O] InChI=1S/C5H9O5/c1-5(3-7,10-9)4(8)2-6/h6-7H,2-3H2,1H3 QGKPQGBKJXFNGV-UHFFFAOYSA-N 149.122 false true C59OOH OCC(=O)C(C)(CO)OO InChI=1S/C5H10O5/c1-5(3-7,10-9)4(8)2-6/h6-7,9H,2-3H2,1H3 JWNCLQLBUYGJMN-UHFFFAOYSA-N 150.1299 false false C5H8 C=CC(=C)C InChI=1S/C5H8/c1-4-5(2)3/h4H,1-2H2,3H3 RRHGJUQNOFWUDK-UHFFFAOYSA-N 68.117 false false ISOPRENE, 78-79-5, 2-Methyl-1,3-butadiene, 2-Methylbuta-1,3-diene, 1,3-Butadiene, 2-methyl- C5HPALD1 C/C(=C/COO)/C=O InChI=1S/C5H8O3/c1-5(4-6)2-3-8-7/h2,4,7H,3H2,1H3/b5-2- DWMPFYPXEBRYFV-DJWKRKHSSA-N 116.1152 false false (Z)-4-Hydroperoxy-2-methyl-2-butenal C5HPALD2 C/C(=C/C=O)/COO InChI=1S/C5H8O3/c1-5(2-3-6)4-8-7/h2-3,7H,4H2,1H3/b5-2- BPZRGIZJNCBMEK-DJWKRKHSSA-N 116.1152 false false (Z)-4-Hydroperoxy-3-methyl-2-butenal, J3.614.822E, [(Z)-4-Hydroperoxy-3-methyl-2-butene-1,1-diyloxy]radical C5PACALD1 C/C(=C/C=O)/C(=O)OO InChI=1S/C5H6O4/c1-4(2-3-6)5(7)9-8/h2-3,8H,1H3/b4-2- UTZOYJZISPOIDM-RQOWECAXSA-N 130.0987 false false C5PACALD2 OOC(=O)/C=C(\C=O)/C InChI=1S/C5H6O4/c1-4(3-6)2-5(7)9-8/h2-3,8H,1H3/b4-2- JLZDPUBRQDSTHL-RQOWECAXSA-N 130.0987 false false C5PAN17 OCC(=CC(=O)OON(=O)=O)C InChI=1S/C5H7NO6/c1-4(3-7)2-5(8)11-12-6(9)10/h2,7H,3H2,1H3 WOHMTHRFBCBPEN-UHFFFAOYSA-N 177.1122 false false C5PAN18 O=N(=O)OCC(=CC(=O)OON(=O)=O)C InChI=1S/C5H6N2O8/c1-4(3-13-6(9)10)2-5(8)14-15-7(11)12/h2H,3H2,1H3 JYUXMKSXMIBDSN-UHFFFAOYSA-N 222.1097 false false C5PAN19 OCC=C(C)C(=O)OON(=O)=O InChI=1S/C5H7NO6/c1-4(2-3-7)5(8)11-12-6(9)10/h2,7H,3H2,1H3 SXXBKHKGTQGHOF-UHFFFAOYSA-N 177.1122 false false CH2CHCH2NO3 [O-][N+](=O)OCC=C InChI=1S/C3H5NO3/c1-2-3-7-4(5)6/h2H,1,3H2 OTRMXXQNSIVZNR-UHFFFAOYSA-N 103.0767 false false 16770-74-4, Nitric acid, 2-propen-1-yl ester, Prop-2-enyl Nitrate, 2-propenyl nitrate, allyl nitrate CH2CHCH2O [O]CC=C InChI=1S/C3H5O/c1-2-3-4/h2H,1,3H2 KBXQLYIKVZHIPH-UHFFFAOYSA-N 57.0712 false false (2-Propenyloxy)radical CH2CHCH2O2 [O]OCC=C InChI=1S/C3H5O2/c1-2-3-5-4/h2H,1,3H2 XJNQJZWHWXHHFK-UHFFFAOYSA-N 73.0706 false true (Allylperoxy)radical CH2CHCH2OOH OOCC=C InChI=1S/C3H6O2/c1-2-3-5-4/h2,4H,1,3H2 LYPJURWUGVQBTD-UHFFFAOYSA-N 74.0785 false false 6069-42-7, Hydroperoxide, 2-propenyl, Allyl Hydroperoxide, DTXSID80450680 CH2OO [O-][O+]=C InChI=1S/CH2O2/c1-3-2/h1H2 SBHHFAIXPSFQLT-UHFFFAOYSA-N 46.0254 false false (Methyleneperoxy)radical, 2-Oxylato-2-oxaethane-1-ylium, carbonyl oxide, formaldehyde oxide CH2OOA [O-][O+]=C InChI=1S/CH2O2/c1-3-2/h1H2 SBHHFAIXPSFQLT-UHFFFAOYSA-N 46.0254 true false (Methyleneperoxy)radical, 2-Oxylato-2-oxaethane-1-ylium, carbonyl oxide, formaldehyde oxide CH2OOB [O-][O+]=C InChI=1S/CH2O2/c1-3-2/h1H2 SBHHFAIXPSFQLT-UHFFFAOYSA-N 46.0254 true false (Methyleneperoxy)radical, 2-Oxylato-2-oxaethane-1-ylium, carbonyl oxide, formaldehyde oxide CH2OOC [O-][O+]=C InChI=1S/CH2O2/c1-3-2/h1H2 SBHHFAIXPSFQLT-UHFFFAOYSA-N 46.0254 true false (Methyleneperoxy)radical, 2-Oxylato-2-oxaethane-1-ylium, carbonyl oxide, formaldehyde oxide CH2OOE [O-][O+]=C InChI=1S/CH2O2/c1-3-2/h1H2 SBHHFAIXPSFQLT-UHFFFAOYSA-N 46.0254 true false (Methyleneperoxy)radical, 2-Oxylato-2-oxaethane-1-ylium, carbonyl oxide, formaldehyde oxide CH2OOG [O-][O+]=C InChI=1S/CH2O2/c1-3-2/h1H2 SBHHFAIXPSFQLT-UHFFFAOYSA-N 46.0254 true false (Methyleneperoxy)radical, 2-Oxylato-2-oxaethane-1-ylium, carbonyl oxide, formaldehyde oxide CH3C2H2O2 CC(=C)O[O] InChI=1S/C3H5O2/c1-3(2)5-4/h1H2,2H3 BXFHGVJYZFIAHH-UHFFFAOYSA-N 73.0706 false true CH3CHO CC=O InChI=1S/C2H4O/c1-2-3/h2H,1H3 IKHGUXGNUITLKF-UHFFFAOYSA-N 44.0526 false false aldehyde, acetaldehyde, 75-07-0, ACETYL GROUP, ethanal CH3CHOHCHO CC(O)C=O InChI=1S/C3H6O2/c1-3(5)2-4/h2-3,5H,1H3 BSABBBMNWQWLLU-UHFFFAOYSA-N 74.0785 false false 598-35-6, (+-)-2-Hydroxypropanal, 2-Hydroxypropanal, lactaldehyde, Propanal, 2-hydroxy CH3CHOHCO3 [O]OC(=O)C(C)O InChI=1S/C3H5O4/c1-2(4)3(5)7-6/h2,4H,1H3 PPBGRSNCZMVYRN-UHFFFAOYSA-N 105.0694 false true CH3CHOO [O-][O+]=CC InChI=1S/C2H4O2/c1-2-4-3/h2H,1H3 OATRENYCMVOEIQ-UHFFFAOYSA-N 60.052 false false 1,2-Dioxabutane-1,3-diylradical, 1-Oxa-1-propene1-oxide, acetaldehyde oxide CH3CHOOA [O-][O+]=CC InChI=1S/C2H4O2/c1-2-4-3/h2H,1H3 OATRENYCMVOEIQ-UHFFFAOYSA-N 60.052 true false 1,2-Dioxabutane-1,3-diylradical, 1-Oxa-1-propene1-oxide, acetaldehyde oxide CH3CO2H CC(=O)O InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4) QTBSBXVTEAMEQO-UHFFFAOYSA-N 60.052 false false acetic -acid, acetic acid, acetic acid-, acetic-acid, ACY CH3CO3 CC(=O)O[O] InChI=1S/C2H3O3/c1-2(3)5-4/h1H3 ZBQKPDHUDKSCRS-UHFFFAOYSA-N 75.0434 false true acetyldioxidanyl, (Acetylperoxy) radical, 36709-10-1, Acetylperoxy radical, CH3COO2 CH3CO3H CC(=O)OO InChI=1S/C2H4O3/c1-2(3)5-4/h4H,1H3 KFSLWBXXFJQRDL-UHFFFAOYSA-N 76.0514 false false PERACETIC ACID, 79-21-0, Ethaneperoxoic acid, Peroxyacetic acid, Acetic peroxide CH3COCH2O CC(=O)C[O] InChI=1S/C3H5O2/c1-3(5)2-4/h2H2,1H3 SJUPMICNLPKAFZ-UHFFFAOYSA-N 73.0706 false false 2-Oxopropoxyradical CH3COCH2O2 CC(=O)CO[O] InChI=1S/C3H5O3/c1-3(4)2-6-5/h2H2,1H3 IZQVDMCHUSIAKS-UHFFFAOYSA-N 89.07 false true Propyldioxy, 2-oxo-, 88181-69-5, (2-Oxopropylperoxy)radical, DTXSID50236877 CH3COCH3 CC(=O)C InChI=1S/C3H6O/c1-3(2)4/h1-2H3 CSCPPACGZOOCGX-UHFFFAOYSA-N 58.0791 false false acetone, 67-64-1, 2-propanone, MFCD00008765, Aceton CH3COCO2H OC(=O)C(=O)C InChI=1S/C3H4O3/c1-2(4)3(5)6/h1H3,(H,5,6) LCTONWCANYUPML-UHFFFAOYSA-N 88.0621 false false Pyruvic acid, 127-17-3, 2-Oxopropanoic acid, .alpha.-Ketopropionic acid, acetylformic acid CH3COCO3 CC(=O)C(=O)O[O] InChI=1S/C3H3O4/c1-2(4)3(5)7-6/h1H3 GEQQKAWNNLPQPN-UHFFFAOYSA-N 103.0535 false true CH3COCO3H CC(=O)C(=O)OO InChI=1S/C3H4O4/c1-2(4)3(5)7-6/h6H,1H3 BXASKOSTAOGNPV-UHFFFAOYSA-N 104.0615 false false Peroxypyruvic acid, 1263153-18-9, Peroxy pyruvic acid, Propaneperoxoic acid, 2-oxo-, 71VA4ZQ36F CH3COPAN O=N(=O)OOC(=O)C(=O)C InChI=1S/C3H3NO6/c1-2(5)3(6)9-10-4(7)8/h1H3 BNYSUSDQQIWDSZ-UHFFFAOYSA-N 149.059 false false CH3NO3 CON(=O)=O InChI=1S/CH3NO3/c1-5-2(3)4/h1H3 LRMHVVPPGGOAJQ-UHFFFAOYSA-N 77.0394 false false METHYL NITRATE, 598-58-3, Nitric acid, methyl ester, nitric acid methyl ester, BRN 1699872 CH3O C[O] InChI=1S/CH3O/c1-2/h1H3 GRVDJDISBSALJP-UHFFFAOYSA-N 31.0339 false false 2143-68-2, Methoxy, Methoxy radical, Methoxyl, Methyloxy CH3O2 CO[O] InChI=1S/CH3O2/c1-3-2/h1H3 WTFNSXYULBQCQV-UHFFFAOYSA-N 47.0333 false true Methyldioxy radical, 2143-58-0, Methyldioxy, (Methylperoxy) radical, DTXSID10944007 CH3O2NO2 COON(=O)=O InChI=1S/CH3NO4/c1-5-6-2(3)4/h1H3 LCFGXMPUQSXLCQ-UHFFFAOYSA-N 93.0388 false false (nitroperoxy)methane, 42829-59-4, CH3OONO2, DTXSID30962723, Peroxynitric acid, methyl ester CH3OH CO InChI=1S/CH4O/c1-2/h2H,1H3 OKKJLVBELUTLKV-UHFFFAOYSA-N 32.0419 false false 67-56-1, methanol, methanol-, MOH, methyl alcohol CH3OOH COO InChI=1S/CH4O2/c1-3-2/h2H,1H3 MEUKEBNAABNAEX-UHFFFAOYSA-N 48.0413 false false Methyl hydroperoxide, 3031-73-0, hydroperoxymethane, CCRIS 4486, DTXSID10184401 CH4 C InChI=1S/CH4/h1H4 VNWKTOKETHGBQD-UHFFFAOYSA-N 16.0425 false false methane, 74-82-8, Marsh gas, Methyl hydride, 150036-83-2 CHOCOHCO [O]C(CO)C=O InChI=1S/C3H5O3/c4-1-3(6)2-5/h1,3,5H,2H2 ULQHEXXLOYZXII-UHFFFAOYSA-N 89.07 false false CHOMOHCO3 CC(O)(C=O)C(=O)O[O] InChI=1S/C4H5O5/c1-4(7,2-5)3(6)9-8/h2,7H,1H3 SJLBEPRJGLEPAM-UHFFFAOYSA-N 133.0795 false true CHOMOHCO3H CC(O)(C=O)C(=O)OO InChI=1S/C4H6O5/c1-4(7,2-5)3(6)9-8/h2,7-8H,1H3 AEAZUHMXWJBPCW-UHFFFAOYSA-N 134.0874 false false CHOMOHPAN O=CC(C)(O)C(=O)OON(=O)=O InChI=1S/C4H5NO7/c1-4(8,2-6)3(7)11-12-5(9)10/h2,8H,1H3 UXUAXYPQPQSXRR-UHFFFAOYSA-N 179.085 false false CHOOCHO O=COC=O InChI=1S/C2H2O3/c3-1-5-2-4/h1-2H VGGRCVDNFAQIKO-UHFFFAOYSA-N 74.0355 false false 1558-67-4, formic anhydride, Formic acid, anhydride, formic acid anhydride, formyl formate CHOPRNO3 O=CC(C)ON(=O)=O InChI=1S/C3H5NO4/c1-3(2-5)8-4(6)7/h2-3H,1H3 IIFXHQMWCHWMFS-UHFFFAOYSA-N 119.0761 false false 2-nitrooxypropanal CISOPA C/C(=C/[CH2])/CO InChI=1S/C5H9O/c1-3-5(2)4-6/h3,6H,1,4H2,2H3 CLGHLEUXPPGIBO-UHFFFAOYSA-N 85.1244 false false CISOPAO [O]C/C=C(\CO)/C InChI=1S/C5H9O2/c1-5(4-7)2-3-6/h2,7H,3-4H2,1H3/b5-2- VAGRMNUEVDXLBF-DJWKRKHSSA-N 101.1238 false false CISOPAO2 [O]OC/C=C(\CO)/C InChI=1S/C5H9O3/c1-5(4-6)2-3-8-7/h2,6H,3-4H2,1H3/b5-2- HCSTXZLEBYWOKY-DJWKRKHSSA-N 117.1232 false true [(Z)-4-Hydroxy-3-methyl-2-butenylperoxy]radical CISOPC OC/C=C(\[CH2])/C InChI=1S/C5H9O/c1-5(2)3-4-6/h3,6H,1,4H2,2H3 UFFMNYXYYUVEEC-UHFFFAOYSA-N 85.1244 false false 4-Hydroxy-2-methyl-1-butene-3-ylradical, [(E)-4-Hydroxy-2-methyl-2-butenyl]radical, [(Z)-4-Hydroxy-2-methyl-2-butenyl]radical CISOPCO OC/C=C(\C[O])/C InChI=1S/C5H9O2/c1-5(4-7)2-3-6/h2,6H,3-4H2,1H3/b5-2- KPIQPXJPTQYNNP-DJWKRKHSSA-N 101.1238 false false CISOPCO2 [O]OC/C(=C\CO)/C InChI=1S/C5H9O3/c1-5(2-3-6)4-8-7/h2,6H,3-4H2,1H3/b5-2- IDNPBHCHRRUTQB-DJWKRKHSSA-N 117.1232 false true [(Z)-4-Hydroxy-2-methyl-2-butenylperoxy]radical CL CO CO23C3CHO O=CC(=O)C(=O)C InChI=1S/C4H4O3/c1-3(6)4(7)2-5/h2H,1H3 LVZOZHOAAHWEOQ-UHFFFAOYSA-N 100.0728 false false 1,2,3-butanetrione, 2,3-Dioxobutanal, AKOS026732362, SCHEMBL1695208, SCHEMBL9724270 CO23C4NO3 O=N(=O)OCC(=O)C(=O)C InChI=1S/C4H5NO5/c1-3(6)4(7)2-10-5(8)9/h2H2,1H3 RSORCZUYAJEINP-UHFFFAOYSA-N 147.0862 false false CO24C4CHO O=CC(=O)CC(=O)C InChI=1S/C5H6O3/c1-4(7)2-5(8)3-6/h3H,2H2,1H3 XHTYNUBGBUBFOA-UHFFFAOYSA-N 114.0993 false false Oxalylaceton, SCHEMBL7483396 CO2C3CHO O=CCC(=O)C InChI=1S/C4H6O2/c1-4(6)2-3-5/h3H,2H2,1H3 PKQIDSVLSKFZQC-UHFFFAOYSA-N 86.0892 false false 625-34-3, Acetoacetaldehyde, 3-oxobutanal, Butanal, 3-oxo-, acetylacetaldehyde CO2C3CO2H CC(=O)CC(=O)O InChI=1S/C4H6O3/c1-3(5)2-4(6)7/h2H2,1H3,(H,6,7) WDJHALXBUFZDSR-UHFFFAOYSA-N 102.0886 false false acetoacetic acid, 541-50-4, 3-oxobutanoic acid, AAE, 3-oxobutyric acid CO2C3CO3 CC(=O)CC(=O)O[O] InChI=1S/C4H5O4/c1-3(5)2-4(6)8-7/h2H2,1H3 NJRVTMGCZPXFSC-UHFFFAOYSA-N 117.0801 false true CO2C3CO3H CC(=O)CC(=O)OO InChI=1S/C4H6O4/c1-3(5)2-4(6)8-7/h7H,2H2,1H3 SJOPHMGAZWPERQ-UHFFFAOYSA-N 118.088 false false SCHEMBL987706, ZINC114976137 CO2C3OO [O-][O+]=CCC(=O)C InChI=1S/C4H6O3/c1-4(5)2-3-7-6/h3H,2H2,1H3 LVNCKKVUFYRSMF-UHFFFAOYSA-N 102.0886 false false CO2C3OOA [O-][O+]=CCC(=O)C InChI=1S/C4H6O3/c1-4(5)2-3-7-6/h3H,2H2,1H3 LVNCKKVUFYRSMF-UHFFFAOYSA-N 102.0886 true false CO2C3OOB [O-][O+]=C(CC=O)C InChI=1S/C4H6O3/c1-4(7-6)2-3-5/h3H,2H2,1H3 RRFJATNYIKNZIS-UHFFFAOYSA-N 102.0886 true false CO2C3PAN CC(=O)CC(=O)OON(=O)=O InChI=1S/C4H5NO6/c1-3(6)2-4(7)10-11-5(8)9/h2H2,1H3 VXGDXYQGFKIYIJ-UHFFFAOYSA-N 163.0856 false false CO2H3CHO O=CC(O)C(=O)C InChI=1S/C4H6O3/c1-3(6)4(7)2-5/h2,4,7H,1H3 GTYVZUSWKGYETP-UHFFFAOYSA-N 102.0886 false false 2-hydroxy-3-oxobutanal, Azetonalalkohol, SCHEMBL5030208 CO2H3CO3 CC(=O)C(O)C(=O)O[O] InChI=1S/C4H5O5/c1-2(5)3(6)4(7)9-8/h3,6H,1H3 WWDLBBRSCXTFDE-UHFFFAOYSA-N 133.0795 false true CO2H3CO3H CC(=O)C(O)C(=O)OO InChI=1S/C4H6O5/c1-2(5)3(6)4(7)9-8/h3,6,8H,1H3 WNDCXKJVOGKFRM-UHFFFAOYSA-N 134.0874 false false CO2N3CHO O=CC(ON(=O)=O)C(=O)C InChI=1S/C4H5NO5/c1-3(7)4(2-6)10-5(8)9/h2,4H,1H3 RXLGSPGPVVHCFU-UHFFFAOYSA-N 147.0862 false false CO2N3CO3 [O]OC(=O)C(ON(=O)=O)C(=O)C InChI=1S/C4H4NO7/c1-2(6)3(4(7)12-10)11-5(8)9/h3H,1H3 RDPVMRQHDIKAJF-UHFFFAOYSA-N 178.0771 false true CO2N3CO3H OOC(=O)C(ON(=O)=O)C(=O)C InChI=1S/C4H5NO7/c1-2(6)3(4(7)12-10)11-5(8)9/h3,10H,1H3 PLOOSZKRSUJKKF-UHFFFAOYSA-N 179.085 false false CO2N3PAN O=N(=O)OOC(=O)C(ON(=O)=O)C(=O)C InChI=1S/C4H4N2O9/c1-2(7)3(13-5(9)10)4(8)14-15-6(11)12/h3H,1H3 RXUYCSQEPKEYNB-UHFFFAOYSA-N 224.0826 false false COHM2CO2H O=CC(C)(O)C(=O)O InChI=1S/C4H6O4/c1-4(8,2-5)3(6)7/h2,8H,1H3,(H,6,7) DDNPKLYNPFAIEE-UHFFFAOYSA-N 118.088 false false SCHEMBL5730796 COHM2CO3 CC(O)(C=O)C(=O)O[O] InChI=1S/C4H5O5/c1-4(7,2-5)3(6)9-8/h2,7H,1H3 SJLBEPRJGLEPAM-UHFFFAOYSA-N 133.0795 false true COHM2CO3H CC(O)(C=O)C(=O)OO InChI=1S/C4H6O5/c1-4(7,2-5)3(6)9-8/h2,7-8H,1H3 AEAZUHMXWJBPCW-UHFFFAOYSA-N 134.0874 false false COHM2PAN O=CC(C)(O)C(=O)OON(=O)=O InChI=1S/C4H5NO7/c1-4(8,2-6)3(7)11-12-5(9)10/h2,8H,1H3 UXUAXYPQPQSXRR-UHFFFAOYSA-N 179.085 false false CONM2CHO O=CC(C)(C=O)ON(=O)=O InChI=1S/C4H5NO5/c1-4(2-6,3-7)10-5(8)9/h2-3H,1H3 UXLHNUQVUCPVFF-UHFFFAOYSA-N 147.0862 false false CONM2CO2H O=CC(C)(ON(=O)=O)C(=O)O InChI=1S/C4H5NO6/c1-4(2-6,3(7)8)11-5(9)10/h2H,1H3,(H,7,8) LTGNKSWVEYSUMY-UHFFFAOYSA-N 163.0856 false false CONM2CO3 [O]OC(=O)C(C)(C=O)ON(=O)=O InChI=1S/C4H4NO7/c1-4(2-6,3(7)11-10)12-5(8)9/h2H,1H3 KBYKKRFHGIBCIW-UHFFFAOYSA-N 178.0771 false true CONM2CO3H OOC(=O)C(C)(C=O)ON(=O)=O InChI=1S/C4H5NO7/c1-4(2-6,3(7)11-10)12-5(8)9/h2,10H,1H3 KDPSYMPAERQTCV-UHFFFAOYSA-N 179.085 false false CONM2PAN O=CC(C)(ON(=O)=O)C(=O)OON(=O)=O InChI=1S/C4H4N2O9/c1-4(2-7,14-5(9)10)3(8)13-15-6(11)12/h2H,1H3 PRUSZGKEVUCSBM-UHFFFAOYSA-N 224.0826 false false DHPMEK OOCC(C(=O)C)OO InChI=1S/C4H8O5/c1-3(5)4(9-7)2-8-6/h4,6-7H,2H2,1H3 IRHBGLFNPKNSAS-UHFFFAOYSA-N 136.0371 false false DHPMPAL OOCC(C=O)(OO)C InChI=1S/C4H8O5/c1-4(2-5,9-7)3-8-6/h2,6-7H,3H2,1H3 JNRFTKHQFHBRLC-UHFFFAOYSA-N 136.1033 false false DNC524CO OCC(ON(=O)=O)C(CO)(C=O)ON(=O)=O InChI=1S/C5H8N2O9/c8-1-4(15-6(11)12)5(2-9,3-10)16-7(13)14/h2,4,8,10H,1,3H2 WXHJTLSKHGDJHS-UHFFFAOYSA-N 240.125 false false ETHENO3O [O]CCON(=O)=O InChI=1S/C2H4NO4/c4-1-2-7-3(5)6/h1-2H2 QFALCVQMVGQTKF-UHFFFAOYSA-N 106.0575 false false ETHENO3O2 [O]OCCON(=O)=O InChI=1S/C2H4NO5/c4-3(5)7-1-2-8-6/h1-2H2 SBGXISAEPFJBRS-UHFFFAOYSA-N 122.0569 false true ETHGLY OCCO InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2 LYCAIKOWRPUZTN-UHFFFAOYSA-N 62.0678 false false 1, 2-Ethanediol, 1,2-ethanediol, ETHYLENE GLYCOL, ethylene-glycol, 107-21-1 ETHO2HNO3 OOCCON(=O)=O InChI=1S/C2H5NO5/c4-3(5)7-1-2-8-6/h6H,1-2H2 IYCQDYYQELIXMU-UHFFFAOYSA-N 123.0648 false false ETHOHNO3 OCCON(=O)=O InChI=1S/C2H5NO4/c4-1-2-7-3(5)6/h4H,1-2H2 HTKIMWYSDZQQBP-UHFFFAOYSA-N 107.0654 false false 16051-48-2, 2-Hydroxyethyl nitrate, 1,2-Ethanediol, mononitrate, Ethylene glycol mononitrate, 1,2-Ethanediol, 1-nitrate GAOO [O-][O+]=CCO InChI=1S/C2H4O3/c3-1-2-5-4/h2-3H,1H2 YHBZRNBORPMCFT-UHFFFAOYSA-N 76.0514 false false GAOOB [O-][O+]=CCO InChI=1S/C2H4O3/c3-1-2-5-4/h2-3H,1H2 YHBZRNBORPMCFT-UHFFFAOYSA-N 76.0514 true false GLYOO [O-][O+]=CC=O InChI=1S/C2H2O3/c3-1-2-5-4/h1-2H LFOPEKCWZGOHHR-UHFFFAOYSA-N 74.0355 false false glyoxaloxid GLYOOB [O-][O+]=CC=O InChI=1S/C2H2O3/c3-1-2-5-4/h1-2H LFOPEKCWZGOHHR-UHFFFAOYSA-N 74.0355 true false glyoxaloxid GLYOOC [O-][O+]=CC=O InChI=1S/C2H2O3/c3-1-2-5-4/h1-2H LFOPEKCWZGOHHR-UHFFFAOYSA-N 74.0355 true false glyoxaloxid GLYOX O=CC=O InChI=1S/C2H2O2/c3-1-2-4/h1-2H LEQAOMBKQFMDFZ-UHFFFAOYSA-N 58.0361 false false 107-22-2, GLYOXAL, Ethanedial, Oxalaldehyde, oxaldehyde H13CO2C3 OCC(=O)CO InChI=1S/C3H6O3/c4-1-3(6)2-5/h4-5H,1-2H2 RXKJFZQQPQGTFL-UHFFFAOYSA-N 90.0779 false false 96-26-4, 1,3-dihydroxyacetone, Dihydroxyacetone, 1, 3-dihydroxypropan-2-one, 1,3-Dihydroxypropan-2-one H13CO2CHO OC(C=O)C(=O)CO InChI=1S/C4H6O4/c5-1-3(7)4(8)2-6/h1,3,6-7H,2H2 RAPYKXPBVBNJGC-UHFFFAOYSA-N 118.088 false false 2,4-dihydroxy-3-oxobutanal, SCHEMBL5810017 H13CO2CO3 OCC(=O)C(O)C(=O)O[O] InChI=1S/C4H5O6/c5-1-2(6)3(7)4(8)10-9/h3,5,7H,1H2 VHMPWJQOVPCJCV-UHFFFAOYSA-N 149.0789 false true H13CO2CO3H OCC(=O)C(O)C(=O)OO InChI=1S/C4H6O6/c5-1-2(6)3(7)4(8)10-9/h3,5,7,9H,1H2 RXVYYLAFXUAZCR-UHFFFAOYSA-N 150.0868 false false H14CO23C4 OCC(=O)C(=O)CO InChI=1S/C4H6O4/c5-1-3(7)4(8)2-6/h5-6H,1-2H2 GJCZUCLKDGABDS-UHFFFAOYSA-N 118.088 false false 1,4-Dihydroxy-2,3-butanedione, 162369-87-1, DTXSID801307704, Dimethylolglyoxal, SCHEMBL2063233 H1CO23CHO OCC(=O)C(=O)C=O InChI=1S/C4H4O4/c5-1-3(7)4(8)2-6/h1,6H,2H2 XSEYITBSKRUSNL-UHFFFAOYSA-N 116.0722 false false H2 H2O2 HC4ACHO CC(=CC=O)CO InChI=1S/C5H8O2/c1-5(4-7)2-3-6/h2-3,7H,4H2,1H3 BSHDRMLUCYMQOP-UHFFFAOYSA-N 100.1158 false false 4-hydroxy-3-methyl-2-butenal, 71197-55-2, DTXSID301343606 HC4ACO2H OCC(=CC(=O)O)C InChI=1S/C5H8O3/c1-4(3-6)2-5(7)8/h2,6H,3H2,1H3,(H,7,8) BERUOTKXCOOJJM-UHFFFAOYSA-N 116.1152 false false 4-hydroxy-3-methylbut-2-enoic acid, AKOS017386858, CHEBI:193611 HC4ACO3 OCC(=CC(=O)O[O])C InChI=1S/C5H7O4/c1-4(3-6)2-5(7)9-8/h2,6H,3H2,1H3 GPKUTRQEHILBEG-UHFFFAOYSA-N 131.1067 false true HC4ACO3H OCC(=CC(=O)OO)C InChI=1S/C5H8O4/c1-4(3-6)2-5(7)9-8/h2,6,8H,3H2,1H3 RKJIARBOZVRICG-UHFFFAOYSA-N 132.1146 false false HC4CCHO CC(=CCO)C=O InChI=1S/C5H8O2/c1-5(4-7)2-3-6/h2,4,6H,3H2,1H3 GCHJBJOOADXJFT-UHFFFAOYSA-N 100.1158 false false 88322-53-6, 4-hydroxy-2-methylbut-2-enal, 2-Methyl-4-hydroxy-2-butenal, DTXSID90720689 HC4CCO2H OCC=C(C)C(=O)O InChI=1S/C5H8O3/c1-4(2-3-6)5(7)8/h2,6H,3H2,1H3,(H,7,8) NCQCQZXQBYAHBZ-UHFFFAOYSA-N 116.1152 false false AKOS017408878 HC4CCO3 OCC=C(C)C(=O)O[O] InChI=1S/C5H7O4/c1-4(2-3-6)5(7)9-8/h2,6H,3H2,1H3 ZYRYJHQQWJDGNV-UHFFFAOYSA-N 131.1067 false true HC4CCO3H OCC=C(C)C(=O)OO InChI=1S/C5H8O4/c1-4(2-3-6)5(7)9-8/h2,6,8H,3H2,1H3 BKBSBVFBLVOVGK-UHFFFAOYSA-N 132.1146 false false HC4CHO CC(=C)C(C=O)O InChI=1S/C5H8O2/c1-4(2)5(7)3-6/h3,5,7H,1H2,2H3 MXORORWCJYYUMM-UHFFFAOYSA-N 100.1158 false false AKOS017729576, SCHEMBL15659879 HC4CO3 CC(=C)C(C(=O)O[O])O InChI=1S/C5H7O4/c1-3(2)4(6)5(7)9-8/h4,6H,1H2,2H3 PNCAYXIOMVCESL-UHFFFAOYSA-N 131.1067 false true HC4CO3H CC(=C)C(C(=O)OO)O InChI=1S/C5H8O4/c1-3(2)4(6)5(7)9-8/h4,6,8H,1H2,2H3 HWTQMMLLMODCRL-UHFFFAOYSA-N 132.1146 false false HC4PAN [O-][N+](=O)OOC(=O)C(C(=C)C)O InChI=1S/C5H7NO6/c1-3(2)4(7)5(8)11-12-6(9)10/h4,7H,1H2,2H3 ZYOQTMPEVAGSHB-UHFFFAOYSA-N 177.1122 false false HCHO C=O InChI=1S/CH2O/c1-2/h1H2 WSFSSNUMVMOOMR-UHFFFAOYSA-N 30.026 false false 50-00-0, formaldehyde, CARBON-MONOXIDE, 30525-89-4, methanal HCOC5 CC(=C)C(=O)CO InChI=1S/C5H8O2/c1-4(2)5(7)3-6/h6H,1,3H2,2H3 LSMLKPXBSFFBNR-UHFFFAOYSA-N 100.1158 false false 1-Hydroxy-3-methyl-3-butene-2-one, SCHEMBL6914033 HCOCH2O [O]CC=O InChI=1S/C2H3O2/c3-1-2-4/h1H,2H2 GXBYUAHVCCRBRG-UHFFFAOYSA-N 59.044 false false (2-Oxoethoxy)radical HCOCH2O2 [O]OCC=O InChI=1S/C2H3O3/c3-1-2-5-4/h1H,2H2 HZOQOHLFIFVFBB-UHFFFAOYSA-N 75.0434 false true (2-Oxoethylperoxy)radical HCOCH2OOH OOCC=O InChI=1S/C2H4O3/c3-1-2-5-4/h1,4H,2H2 TUJPSEFVDYHSJJ-UHFFFAOYSA-N 76.0514 false false 41767-86-6, Hydroperoxyacetaldehyde, (Hydroperoxy)ethanal, DTXSID10711716 HCOCO O=[C]C=O InChI=1S/C2HO2/c3-1-2-4/h1H IKFPMWBBLSRQRA-UHFFFAOYSA-N 57.0281 false false Glyoxyloylradical HCOCO2H O=CC(=O)O InChI=1S/C2H2O3/c3-1-2(4)5/h1H,(H,4,5) HHLFWLYXYJOTON-UHFFFAOYSA-N 74.0355 false false glyoxylic acid, 298-12-4, GLV, 2-Oxoacetic Acid, Glyoxalic acid HCOCO3 [O]OC(=O)C=O InChI=1S/C2HO4/c3-1-2(4)6-5/h1H YGDQQEIKYNOQOL-UHFFFAOYSA-N 89.0269 false true (Glyoxyloylperoxy)radical HCOCO3H OOC(=O)C=O InChI=1S/C2H2O4/c3-1-2(4)6-5/h1,5H JOALXJIWVKUVBR-UHFFFAOYSA-N 90.0349 false false hydroxy glyoxylate HCOCOHCO3 OC(C=O)C(=O)O[O] InChI=1S/C3H3O5/c4-1-2(5)3(6)8-7/h1-2,5H XUWOWWCRHIVJMN-UHFFFAOYSA-N 119.0529 false true HCOCOHCO3H OC(C=O)C(=O)OO InChI=1S/C3H4O5/c4-1-2(5)3(6)8-7/h1-2,5,7H DIZMXPJJIVKAJT-UHFFFAOYSA-N 120.0609 false false HCOCOHPAN O=CC(O)C(=O)OON(=O)=O InChI=1S/C3H3NO7/c5-1-2(6)3(7)10-11-4(8)9/h1-2,6H GGQYFRDCXKQQIA-UHFFFAOYSA-N 165.0584 false false HCOOH OC=O InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3) BDAGIHXWWSANSR-UHFFFAOYSA-N 46.0254 false false formic acid, 64-18-6, Methanoic acid, Aminic acid, Formylic acid HIEB1O OCC(O)C([O])(CO)C=O InChI=1S/C5H9O5/c6-1-4(9)5(10,2-7)3-8/h2,4,6,8-9H,1,3H2 MNNDDRWTXDNUIS-UHFFFAOYSA-N 149.122 false false HIEB1O2 OCC(O)C(CO)(O[O])C=O InChI=1S/C5H9O6/c6-1-4(9)5(2-7,3-8)11-10/h2,4,6,8-9H,1,3H2 CTXRGTNLNHNTQW-UHFFFAOYSA-N 165.1214 false true HIEB1OOH OCC(O)C(CO)(OO)C=O InChI=1S/C5H10O6/c6-1-4(9)5(2-7,3-8)11-10/h2,4,6,8-10H,1,3H2 COFCBVJXHDFSHS-UHFFFAOYSA-N 166.1293 false false HIEB2O O=CC([O])C(O)(CO)CO InChI=1S/C5H9O5/c6-1-4(9)5(10,2-7)3-8/h1,4,7-8,10H,2-3H2 YKJAIVKWKFBBKS-UHFFFAOYSA-N 149.122 false false HIEB2O2 [O]OC(C=O)C(O)(CO)CO InChI=1S/C5H9O6/c6-1-4(11-10)5(9,2-7)3-8/h1,4,7-9H,2-3H2 ZRHWUFMQZHXZDJ-UHFFFAOYSA-N 165.1214 false true HIEB2OOH OOC(C=O)C(O)(CO)CO InChI=1S/C5H10O6/c6-1-4(11-10)5(9,2-7)3-8/h1,4,7-10H,2-3H2 PKIUCWJPHHVKPZ-UHFFFAOYSA-N 166.1293 false false HIEPOXB OCC1OC1(CO)CO InChI=1S/C5H10O4/c6-1-4-5(2-7,3-8)9-4/h4,6-8H,1-3H2 YTIKZIBPNMOYQX-UHFFFAOYSA-N 134.1305 false false SCHEMBL2884221 HMAC OC=C(C=O)C InChI=1S/C4H6O2/c1-4(2-5)3-6/h2-3,5H,1H3 GJYMRMWAVJYYEK-UHFFFAOYSA-N 86.0892 false false 57325-58-3, 2-Propenal, 3-hydroxy-2-methyl-, DTXSID60388790 HMACO2H OCC(=C)C(=O)O InChI=1S/C4H6O3/c1-3(2-5)4(6)7/h5H,1-2H2,(H,6,7) AAMTXHVZOHPPQR-UHFFFAOYSA-N 102.0886 false false 4370-80-3, 2-(Hydroxymethyl)acrylic acid, 2-(hydroxymethyl)prop-2-enoic acid, Hydroxymethylacrylic acid, 2-(Hydroxymethyl)-2-propenoic acid HMACO3 OCC(=C)C(=O)O[O] InChI=1S/C4H5O4/c1-3(2-5)4(6)8-7/h5H,1-2H2 QNKLOHCPADYXPK-UHFFFAOYSA-N 117.0801 false true HMACO3H OCC(=C)C(=O)OO InChI=1S/C4H6O4/c1-3(2-5)4(6)8-7/h5,7H,1-2H2 IZGOVIKWSGSSGB-UHFFFAOYSA-N 118.088 false false HMACR OCC(=C)C=O InChI=1S/C4H6O2/c1-4(2-5)3-6/h2,6H,1,3H2 QVBICLGJAQXLSA-UHFFFAOYSA-N 86.0892 false false 2-(Hydroxymethyl)propenal, 2-hydroxymethyl-propenal, 40364-84-9, DTXSID70897282 HMACRO OCC([O])(CO)C=O InChI=1S/C4H7O4/c5-1-4(8,2-6)3-7/h1,6-7H,2-3H2 BYSDHTHVCZSQOX-UHFFFAOYSA-N 119.096 false false HMACRO2 OCC(CO)(O[O])C=O InChI=1S/C4H7O5/c5-1-4(2-6,3-7)9-8/h1,6-7H,2-3H2 IDXJKMOOSMRTAL-UHFFFAOYSA-N 135.0954 false true HMACROH OCC(O)(CO)C=O InChI=1S/C4H8O4/c5-1-4(8,2-6)3-7/h1,6-8H,2-3H2 OUEKYUKJSLEOIU-UHFFFAOYSA-N 120.1039 false false 2-c-(hydroxymethyl)glyceraldehyde, SCHEMBL2427776 HMACROOH OCC(CO)(OO)C=O InChI=1S/C4H8O5/c5-1-4(2-6,3-7)9-8/h1,6-8H,2-3H2 AWITZWJPGUOCMB-UHFFFAOYSA-N 136.1033 false false HMGLOO [O-][O+]=CC(=O)CO InChI=1S/C3H4O4/c4-1-3(5)2-7-6/h2,4H,1H2 FOEOYLVXIWJZPN-UHFFFAOYSA-N 104.0615 false false HMGLOOA [O-][O+]=CC(=O)CO InChI=1S/C3H4O4/c4-1-3(5)2-7-6/h2,4H,1H2 FOEOYLVXIWJZPN-UHFFFAOYSA-N 104.0615 true false HMGLYOO [O-]/[O+]=C(\CO)/C=O InChI=1S/C3H4O4/c4-1-3(2-5)7-6/h1,5H,2H2 AVFOPYDUHQQAMG-UHFFFAOYSA-N 104.0615 false false HMGLYOOA [O-]/[O+]=C(\CO)/C=O InChI=1S/C3H4O4/c4-1-3(2-5)7-6/h1,5H,2H2 AVFOPYDUHQQAMG-UHFFFAOYSA-N 104.0615 true false HMML CC1(CO)OC1=O InChI=1S/C4H6O3/c1-4(2-5)3(6)7-4/h5H,2H2,1H3 GZBUICGDPKIUBB-UHFFFAOYSA-N 102.0886 false false 3-(Hydroxymethyl)-3-methyloxirane-2-one HMPAN OCC(=C)C(=O)OON(=O)=O InChI=1S/C4H5NO6/c1-3(2-6)4(7)10-11-5(8)9/h6H,1-2H2 XPXMBKPWAOWOBP-UHFFFAOYSA-N 163.0856 false false HMVKANO3 O=N(=O)OCC(O)C(=O)C InChI=1S/C4H7NO5/c1-3(6)4(7)2-10-5(8)9/h4,7H,2H2,1H3 UFDPWCOBIOWDKA-UHFFFAOYSA-N 149.1021 false false HMVKAO CC(=O)C(O)C[O] InChI=1S/C4H7O3/c1-3(6)4(7)2-5/h4,7H,2H2,1H3 GHSBDQGITHQRTG-UHFFFAOYSA-N 103.0966 false false HMVKAO2 CC(=O)C(O)CO[O] InChI=1S/C4H7O4/c1-3(5)4(6)2-8-7/h4,6H,2H2,1H3 LJWFIXGKRBZGTB-UHFFFAOYSA-N 119.096 false true HMVKAOOH CC(=O)C(O)COO InChI=1S/C4H8O4/c1-3(5)4(6)2-8-7/h4,6-7H,2H2,1H3 XTELZFGIGJBUGR-UHFFFAOYSA-N 120.1039 false false HMVKBO CC(=O)C([O])CO InChI=1S/C4H7O3/c1-3(6)4(7)2-5/h4-5H,2H2,1H3 RVMBSYNKRJRHIY-UHFFFAOYSA-N 103.0966 false false HMVKBO2 OCC(O[O])C(=O)C InChI=1S/C4H7O4/c1-3(6)4(2-5)8-7/h4-5H,2H2,1H3 LYUBMYXEGUUIOF-UHFFFAOYSA-N 119.096 false true HMVKBOOH OCC(OO)C(=O)C InChI=1S/C4H8O4/c1-3(6)4(2-5)8-7/h4-5,7H,2H2,1H3 NGLQGLCPXKPDMS-UHFFFAOYSA-N 120.1039 false false HMVKNGLYOX OCC(ON(=O)=O)C(=O)C=O InChI=1S/C4H5NO6/c6-1-3(8)4(2-7)11-5(9)10/h1,4,7H,2H2 VDDXFUNTPSDTJP-UHFFFAOYSA-N 163.0856 false false HMVKNO3 OCC(=O)C(CO)ON(=O)=O InChI=1S/C4H7NO6/c6-1-3(8)4(2-7)11-5(9)10/h4,6-7H,1-2H2 NCLLRWDJHCXXDR-UHFFFAOYSA-N 165.1015 false false HNC524CO OCC(ON(=O)=O)C(O)(CO)C=O InChI=1S/C5H9NO7/c7-1-4(13-6(11)12)5(10,2-8)3-9/h2,4,7,9-10H,1,3H2 UHQMTOKWUFCERL-UHFFFAOYSA-N 195.1275 false false HNO3 HO12CO3C4 CC(=O)C(O)CO InChI=1S/C4H8O3/c1-3(6)4(7)2-5/h4-5,7H,2H2,1H3 SEYLPRWNVFCVRQ-UHFFFAOYSA-N 104.1045 false false 57011-15-1, 3,4-dihydroxybutan-2-one, 3,4-dihydroxy-2-butanone, DTXSID30574380, SCHEMBL1926067 HO1CO24C5 CC(=O)CC(=O)CO InChI=1S/C5H8O3/c1-4(7)2-5(8)3-6/h6H,2-3H2,1H3 VBUBLWCIADYRMB-UHFFFAOYSA-N 116.1152 false false 61144-86-3, 1-Hydroxypentane-2,4-dione, DTXSID30577275, Oxyacetylaceton, SCHEMBL2009158 HO2 HO2NO2 HOCH2CH2O OCC[O] InChI=1S/C2H5O2/c3-1-2-4/h3H,1-2H2 QKCFVDWBORTSIN-UHFFFAOYSA-N 61.0599 false false 2-Hydroxyethoxyradical HOCH2CH2O2 OCCO[O] InChI=1S/C2H5O3/c3-1-2-5-4/h3H,1-2H2 AONOSQAJVFLOQD-UHFFFAOYSA-N 77.0593 false true (2-Hydroxyethylperoxy)radical HOCH2CHO OCC=O InChI=1S/C2H4O2/c3-1-2-4/h1,4H,2H2 WGCNASOHLSPBMP-UHFFFAOYSA-N 60.052 false false 141-46-8, glycolaldehyde, 2-Hydroxyacetaldehyde, hydroxyacetaldehyde, Acetaldehyde, hydroxy- HOCH2CO2H OCC(=O)O InChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5) AEMRFAOFKBGASW-UHFFFAOYSA-N 76.0514 false false glycolic acid, 79-14-1, 2-Hydroxyacetic acid, GOA, hydroxyacetic acid HOCH2CO3 OCC(=O)O[O] InChI=1S/C2H3O4/c3-1-2(4)6-5/h3H,1H2 GOSHLRYOEQSDFZ-UHFFFAOYSA-N 91.0428 false true (2-Hydroxyacetylperoxy)radical HOCH2CO3H OCC(=O)OO InChI=1S/C2H4O4/c3-1-2(4)6-5/h3,5H,1H2 IUEZWLCUORJBDZ-UHFFFAOYSA-N 92.0508 false false 21860-08-2, Ethaneperoxoic acid, hydroxy-, DTXSID90430695, hydroxy peracetic acid HOCH2COCHO OCC(=O)C=O InChI=1S/C3H4O3/c4-1-3(6)2-5/h1,5H,2H2 JLPAWRLRMTZCSF-UHFFFAOYSA-N 88.0621 false false 997-10-4, Hydroxypyruvaldehyde, 3-Hydroxy-2-oxopropanal, PYRUVALDEHYDE, HYDROXY-, NSC 409965 HOCH2COCO2H OCC(=O)C(=O)O InChI=1S/C3H4O4/c4-1-2(5)3(6)7/h4H,1H2,(H,6,7) HHDDCCUIIUWNGJ-UHFFFAOYSA-N 104.0615 false false 1113-60-6, 3-Hydroxypyruvic acid, hydroxypyruvic acid, 3-Hydroxy-2-oxopropanoic acid, 3PY HOCHOCOOH OCC(OO)C=O InChI=1S/C3H6O4/c4-1-3(2-5)7-6/h1,3,5-6H,2H2 GWWSSJVARZQKFN-UHFFFAOYSA-N 106.0773 false false HONO HPC52CO3 OOCC(C(C(=O)O[O])O)(OO)C InChI=1S/C5H9O8/c1-5(13-10,2-11-8)3(6)4(7)12-9/h3,6,8,10H,2H2,1H3 LGHLGFFAFDWCHC-UHFFFAOYSA-N 197.1202 false true HPC52CO3H OOCC(C(C(=O)OO)O)(OO)C InChI=1S/C5H10O8/c1-5(13-10,2-11-8)3(6)4(7)12-9/h3,6,8-10H,2H2,1H3 MDGMQELPWHGMAR-UHFFFAOYSA-N 198.1281 false false HPC52O CC(C(C=O)O)(COO)[O] InChI=1S/C5H9O5/c1-5(8,3-10-9)4(7)2-6/h2,4,7,9H,3H2,1H3 HJFUYLJCINULAZ-UHFFFAOYSA-N 149.122 false false HPC52O2 OOCC(C(C=O)O)(O[O])C InChI=1S/C5H9O6/c1-5(11-9,3-10-8)4(7)2-6/h2,4,7-8H,3H2,1H3 AIGGCLNSVTYROJ-UHFFFAOYSA-N 165.1214 false true HPC52OOH OOCC(C(C=O)O)(OO)C InChI=1S/C5H10O6/c1-5(11-9,3-10-8)4(7)2-6/h2,4,7-9H,3H2,1H3 LTQFVKPWBSZVIT-UHFFFAOYSA-N 166.1293 false false HPC52PAN OOCC(C(C(=O)OO[N+](=O)[O-])O)(OO)C InChI=1S/C5H9NO10/c1-5(15-12,2-13-11)3(7)4(8)14-16-6(9)10/h3,7,11-12H,2H2,1H3 DQKJPJVDCYWVEC-UHFFFAOYSA-N 243.1257 false false HPNC524CO OCC(ON(=O)=O)C(CO)(OO)C=O InChI=1S/C5H9NO8/c7-1-4(13-6(10)11)5(2-8,3-9)14-12/h2,4,7,9,12H,1,3H2 QASKBBWYYSGCPQ-UHFFFAOYSA-N 211.1269 false false HSO3 HVMK CC(=O)C=CO InChI=1S/C4H6O2/c1-4(6)2-3-5/h2-3,5H,1H3 ZTHWSXBXEILDKD-UHFFFAOYSA-N 86.0892 false false 3-Hydroxy-2-butenal HYETHO2H OCCOO InChI=1S/C2H6O3/c3-1-2-5-4/h3-4H,1-2H2 FKPAKAOEHCFKLE-UHFFFAOYSA-N 78.0672 false false 2-Hydroxyethyl hydroperoxide, hydroxyethyl hydroperoxide HYPERACET CC(=O)COO InChI=1S/C3H6O3/c1-3(4)2-6-5/h5H,2H2,1H3 LSIGHSKIPNHVEN-UHFFFAOYSA-N 90.0779 false false 2-Oxopropyl hydroperoxide, Peroxylacetone HYPROPO OCC(C)[O] InChI=1S/C3H7O2/c1-3(5)2-4/h3-4H,2H2,1H3 QLOCVKCVYSJXCJ-UHFFFAOYSA-N 75.0865 false false (1-Hydroxypropane-2-yloxy)radical HYPROPO2 OCC(C)O[O] InChI=1S/C3H7O3/c1-3(2-4)6-5/h3-4H,2H2,1H3 WIGWWTFOYYDYIR-UHFFFAOYSA-N 91.0859 false true (1-Hydroxypropane-2-ylperoxy)radical, J3.646.900E HYPROPO2H OCC(C)OO InChI=1S/C3H8O3/c1-3(2-4)6-5/h3-5H,2H2,1H3 CGHALRGHFXEMJB-UHFFFAOYSA-N 92.0938 false false 98571-41-6, 2-Hydroperoxypropan-1-ol, DTXSID20591187 IBUTALOH O=CC(C)(C)O InChI=1S/C4H8O2/c1-4(2,6)3-5/h3,6H,1-2H3 HNVAGBIANFAIIL-UHFFFAOYSA-N 88.1051 false false 20818-81-9, 2-hydroxy-2-methylpropanal, 2-Hydroxy-2-methylpropionaldehyde, 2-hydroxyisobutyraldehyde, EINECS 244-059-2 IEACHO CC(O)(C=O)C1CO1 InChI=1S/C5H8O3/c1-5(7,3-6)4-2-8-4/h3-4,7H,2H2,1H3 SXTKPSXTIDLSQV-UHFFFAOYSA-N 116.1152 false false IEACO3 CC(O)(C1CO1)C(=O)O[O] InChI=1S/C5H7O5/c1-5(7,3-2-9-3)4(6)10-8/h3,7H,2H2,1H3 NUIKLUKKVUFPCY-UHFFFAOYSA-N 147.1061 false true IEACO3H CC(O)(C1CO1)C(=O)OO InChI=1S/C5H8O5/c1-5(7,3-2-9-3)4(6)10-8/h3,7-8H,2H2,1H3 WBOLSVSGSKMCPN-UHFFFAOYSA-N 148.114 false false IEAPAN O=N(=O)OOC(=O)C(C)(O)C1OC1 InChI=1S/C5H7NO7/c1-5(8,3-2-11-3)4(7)12-13-6(9)10/h3,8H,2H2,1H3 NFJKKZSQGXUZSI-UHFFFAOYSA-N 193.1116 false false IEB1CHO CC1(OC1CO)C=O InChI=1S/C5H8O3/c1-5(3-7)4(2-6)8-5/h3-4,6H,2H2,1H3 KVRVSGYNPULSIE-UHFFFAOYSA-N 116.1152 false false IEB4CHO CC1(CO)OC1C=O InChI=1S/C5H8O3/c1-5(3-7)4(2-6)8-5/h2,4,7H,3H2,1H3 DNQIATHBSKHPLN-UHFFFAOYSA-N 116.1152 false false IEC2OOH OCC(=O)C(C)(OO)C=O InChI=1S/C5H8O5/c1-5(3-7,10-9)4(8)2-6/h3,6,9H,2H2,1H3 KGZJHQJCDPZOFG-UHFFFAOYSA-N 148.114 false false IECCHO CC1(CO1)C(O)C=O InChI=1S/C5H8O3/c1-5(3-8-5)4(7)2-6/h2,4,7H,3H2,1H3 FUNIHXJAXNKVQS-UHFFFAOYSA-N 116.1152 false false IECCO3 CC1(CO1)C(O)C(=O)O[O] InChI=1S/C5H7O5/c1-5(2-9-5)3(6)4(7)10-8/h3,6H,2H2,1H3 HYRWOPFYLFFQID-UHFFFAOYSA-N 147.1061 false true IECCO3H CC1(CO1)C(O)C(=O)OO InChI=1S/C5H8O5/c1-5(2-9-5)3(6)4(7)10-8/h3,6,8H,2H2,1H3 CEWHGLGNUIHIJU-UHFFFAOYSA-N 148.114 false false IECPAN O=N(=O)OOC(=O)C(O)C1(C)OC1 InChI=1S/C5H7NO7/c1-5(2-11-5)3(7)4(8)12-13-6(9)10/h3,7H,2H2,1H3 UMKIAKGFUATPHT-UHFFFAOYSA-N 193.1116 false false IEPOXA CC(O)(CO)C1CO1 InChI=1S/C5H10O3/c1-5(7,3-6)4-2-8-4/h4,6-7H,2-3H2,1H3 CIDUHKBATDRWPE-UHFFFAOYSA-N 118.1311 false false 2-(Oxirane-2-yl)-1,2-propanediol IEPOXB OCC1OC1(C)CO InChI=1S/C5H10O3/c1-5(3-7)4(2-6)8-5/h4,6-7H,2-3H2,1H3 FLVAIUDBQNOKHB-UHFFFAOYSA-N 118.1311 false false 2-Methyloxirane-2,3-dimethanol, SCHEMBL6438289 IEPOXC CC1(CO1)C(O)CO InChI=1S/C5H10O3/c1-5(3-8-5)4(7)2-6/h4,6-7H,2-3H2,1H3 REKLCZSNEUFIBP-UHFFFAOYSA-N 118.1311 false false 3-Methyl-3,4-epoxybutane-1,2-diol INAHCHO O=CC(C)(O)C(O)CON(=O)=O InChI=1S/C5H9NO6/c1-5(9,3-7)4(8)2-12-6(10)11/h3-4,8-9H,2H2,1H3 GJDCYRXOLZPRRL-UHFFFAOYSA-N 179.1281 false false INAHCO2H O=N(=O)OCC(O)C(C)(O)C(=O)O InChI=1S/C5H9NO7/c1-5(10,4(8)9)3(7)2-13-6(11)12/h3,7,10H,2H2,1H3,(H,8,9) KDGUUBLLRPAORR-UHFFFAOYSA-N 195.1275 false false INAHCO3 [O]OC(=O)C(C)(O)C(O)CON(=O)=O InChI=1S/C5H8NO8/c1-5(9,4(8)14-12)3(7)2-13-6(10)11/h3,7,9H,2H2,1H3 ULXIOWJAXKDTHV-UHFFFAOYSA-N 210.1189 false true INAHCO3H OOC(=O)C(C)(O)C(O)CON(=O)=O InChI=1S/C5H9NO8/c1-5(9,4(8)14-12)3(7)2-13-6(10)11/h3,7,9,12H,2H2,1H3 NANYPKIUOGNJFQ-UHFFFAOYSA-N 211.1269 false false INAHPAN O=N(=O)OCC(O)C(C)(O)C(=O)OON(=O)=O InChI=1S/C5H8N2O10/c1-5(10,3(8)2-15-6(11)12)4(9)16-17-7(13)14/h3,8,10H,2H2,1H3 ISRNXRSYOJKFEQ-UHFFFAOYSA-N 256.1244 false false INAHPCHO OOC(C)(C=O)C(O)CON(=O)=O InChI=1S/C5H9NO7/c1-5(3-7,13-11)4(8)2-12-6(9)10/h3-4,8,11H,2H2,1H3 WOIAKHQAPCBXNP-UHFFFAOYSA-N 195.1275 false false INAHPCO2H OOC(C)(C(=O)O)C(O)CON(=O)=O InChI=1S/C5H9NO8/c1-5(14-12,4(8)9)3(7)2-13-6(10)11/h3,7,12H,2H2,1H3,(H,8,9) CHIYBIMSWIBBRD-UHFFFAOYSA-N 211.1269 false false INAHPCO3 [O]OC(=O)C(C)(OO)C(O)CON(=O)=O InChI=1S/C5H8NO9/c1-5(15-12,4(8)14-11)3(7)2-13-6(9)10/h3,7,12H,2H2,1H3 HAPJXZAGPMJOLW-UHFFFAOYSA-N 226.1183 false true INAHPCO3H OOC(=O)C(C)(OO)C(O)CON(=O)=O InChI=1S/C5H9NO9/c1-5(15-12,4(8)14-11)3(7)2-13-6(9)10/h3,7,11-12H,2H2,1H3 ZYWYMWCOZFANRV-UHFFFAOYSA-N 227.1263 false false INAHPPAN OOC(C)(C(O)CON(=O)=O)C(=O)OON(=O)=O InChI=1S/C5H8N2O11/c1-5(17-14,3(8)2-15-6(10)11)4(9)16-18-7(12)13/h3,8,14H,2H2,1H3 ZXVKOORKVQYPPA-UHFFFAOYSA-N 272.1238 false false INANCHO O=CC(C)(ON(=O)=O)C(O)CON(=O)=O InChI=1S/C5H8N2O8/c1-5(3-8,15-7(12)13)4(9)2-14-6(10)11/h3-4,9H,2H2,1H3 AOWQROMNZIXQRL-UHFFFAOYSA-N 224.1256 false false INANCO OCC(C)(ON(=O)=O)C(=O)CON(=O)=O InChI=1S/C5H8N2O8/c1-5(3-8,15-7(12)13)4(9)2-14-6(10)11/h8H,2-3H2,1H3 IESHUNGXVKLDSS-UHFFFAOYSA-N 224.1256 false false 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LXTUVHDUSAOJOD-UHFFFAOYSA-N 240.125 false false INCNCO3 [O]OC(=O)C(ON(=O)=O)C(C)(O)CON(=O)=O InChI=1S/C5H7N2O10/c1-5(9,2-15-6(10)11)3(4(8)17-14)16-7(12)13/h3,9H,2H2,1H3 SHPYUMLWPJUWTG-UHFFFAOYSA-N 255.1165 false true INCNCO3H OOC(=O)C(ON(=O)=O)C(C)(O)CON(=O)=O InChI=1S/C5H8N2O10/c1-5(9,2-15-6(10)11)3(4(8)17-14)16-7(12)13/h3,9,14H,2H2,1H3 OBBLXUYPBVASEH-UHFFFAOYSA-N 256.1244 false false INCNO3 OCC(ON(=O)=O)C(C)(O)CON(=O)=O InChI=1S/C5H10N2O8/c1-5(9,3-14-6(10)11)4(2-8)15-7(12)13/h4,8-9H,2-3H2,1H3 YANCNBBJBURWKL-UHFFFAOYSA-N 226.1415 false false INCNPAN O=N(=O)OOC(=O)C(ON(=O)=O)C(C)(O)CON(=O)=O InChI=1S/C5H7N3O12/c1-5(10,2-17-6(11)12)3(18-7(13)14)4(9)19-20-8(15)16/h3,10H,2H2,1H3 MINPDRSMAYIHHB-UHFFFAOYSA-N 301.122 false false INCO OCC([O])C(C)(O)CON(=O)=O InChI=1S/C5H10NO6/c1-5(9,4(8)2-7)3-12-6(10)11/h4,7,9H,2-3H2,1H3 AENFZGHBKZMNJQ-UHFFFAOYSA-N 180.136 false false INCO2 OCC(O[O])C(C)(O)CON(=O)=O InChI=1S/C5H10NO7/c1-5(8,3-12-6(9)10)4(2-7)13-11/h4,7-8H,2-3H2,1H3 PPVZGXHUODFTEW-UHFFFAOYSA-N 196.1354 false true INCOH OCC(O)C(C)(O)CON(=O)=O InChI=1S/C5H11NO6/c1-5(9,4(8)2-7)3-12-6(10)11/h4,7-9H,2-3H2,1H3 CLYWBEAWDTVRBE-UHFFFAOYSA-N 181.1439 false false INCOOH OCC(OO)C(C)(O)CON(=O)=O InChI=1S/C5H11NO7/c1-5(8,3-12-6(9)10)4(2-7)13-11/h4,7-8,11H,2-3H2,1H3 LZOWWVNBCGLMRZ-UHFFFAOYSA-N 197.1433 false false INDHCHO OCC(ON(=O)=O)C(C)(O)C=O InChI=1S/C5H9NO6/c1-5(9,3-8)4(2-7)12-6(10)11/h3-4,7,9H,2H2,1H3 LXJORHVMGZGMRK-UHFFFAOYSA-N 179.1281 false false INDHCO3 OCC(ON(=O)=O)C(C)(O)C(=O)O[O] InChI=1S/C5H8NO8/c1-5(9,4(8)14-12)3(2-7)13-6(10)11/h3,7,9H,2H2,1H3 JIFKBVFACBPVMA-UHFFFAOYSA-N 210.1189 false true INDHCO3H OCC(ON(=O)=O)C(C)(O)C(=O)OO InChI=1S/C5H9NO8/c1-5(9,4(8)14-12)3(2-7)13-6(10)11/h3,7,9,12H,2H2,1H3 QUYOEJZVAFIYRP-UHFFFAOYSA-N 211.1269 false false INDHPAN OCC(ON(=O)=O)C(C)(O)C(=O)OON(=O)=O InChI=1S/C5H8N2O10/c1-5(10,3(2-8)15-6(11)12)4(9)16-17-7(13)14/h3,8,10H,2H2,1H3 WUJYJPIJVADQSX-UHFFFAOYSA-N 256.1244 false false INDHPCHO OCC(ON(=O)=O)C(C)(OO)C=O InChI=1S/C5H9NO7/c1-5(3-8,13-11)4(2-7)12-6(9)10/h3-4,7,11H,2H2,1H3 NKPKKBYOCYFEQQ-UHFFFAOYSA-N 195.1275 false false INDHPCO3 [O]OC(=O)C(C)(OO)C(CO)ON(=O)=O InChI=1S/C5H8NO9/c1-5(15-12,4(8)14-11)3(2-7)13-6(9)10/h3,7,12H,2H2,1H3 XZHDKIXHKPFABJ-UHFFFAOYSA-N 226.1183 false true INDHPCO3H OOC(=O)C(C)(OO)C(CO)ON(=O)=O InChI=1S/C5H9NO9/c1-5(15-12,4(8)14-11)3(2-7)13-6(9)10/h3,7,11-12H,2H2,1H3 XHWXDLVQLOECHL-UHFFFAOYSA-N 227.1263 false false INDHPPAN OCC(ON(=O)=O)C(C)(OO)C(=O)OON(=O)=O InChI=1S/C5H8N2O11/c1-5(17-14,3(2-8)15-6(10)11)4(9)16-18-7(12)13/h3,8,14H,2H2,1H3 MNXVJBKQIAYCJC-UHFFFAOYSA-N 272.1238 false false INDO OCC(ON(=O)=O)C(C)([O])CO InChI=1S/C5H10NO6/c1-5(9,3-8)4(2-7)12-6(10)11/h4,7-8H,2-3H2,1H3 YSMUUVHUWCDFLW-UHFFFAOYSA-N 180.136 false false INDO2 OCC(ON(=O)=O)C(C)(CO)O[O] InChI=1S/C5H10NO7/c1-5(3-8,13-11)4(2-7)12-6(9)10/h4,7-8H,2-3H2,1H3 RYHUNNPBCRYORG-UHFFFAOYSA-N 196.1354 false true INDOH OCC(ON(=O)=O)C(C)(O)CO InChI=1S/C5H11NO6/c1-5(9,3-8)4(2-7)12-6(10)11/h4,7-9H,2-3H2,1H3 HMAKIHHEIIANEM-UHFFFAOYSA-N 181.1439 false false INDOOH OCC(ON(=O)=O)C(C)(CO)OO InChI=1S/C5H11NO7/c1-5(3-8,13-11)4(2-7)12-6(9)10/h4,7-8,11H,2-3H2,1H3 MAYHMSJZSHQSOH-UHFFFAOYSA-N 197.1433 false false IPRHOCO2H OC(=O)C(C)(C)O InChI=1S/C4H8O3/c1-4(2,7)3(5)6/h7H,1-2H3,(H,5,6) BWLBGMIXKSTLSX-UHFFFAOYSA-N 104.1045 false false 594-61-6, 2-HYDROXYISOBUTYRIC ACID, 2-Hydroxy-2-methylpropanoic acid, 2-Methyllactic acid, .alpha.-Hydroxyisobutyric acid IPRHOCO3 [O]OC(=O)C(C)(C)O InChI=1S/C4H7O4/c1-4(2,6)3(5)8-7/h6H,1-2H3 BWADVNNOMQRCSA-UHFFFAOYSA-N 119.096 false true IPRHOCO3H OOC(=O)C(C)(C)O InChI=1S/C4H8O4/c1-4(2,6)3(5)8-7/h6-7H,1-2H3 VAHIZEUROSIQMC-UHFFFAOYSA-N 120.1039 false false SCHEMBL15821367 IPROPOLO [O]CC(C)O InChI=1S/C3H7O2/c1-3(5)2-4/h3,5H,2H2,1H3 SCILIBBKSJPQSB-UHFFFAOYSA-N 75.0865 false false (2-Hydroxypropoxy)radical IPROPOLO2 [O]OCC(C)O InChI=1S/C3H7O3/c1-3(4)2-6-5/h3-4H,2H2,1H3 DLGAAXCIAHWHID-UHFFFAOYSA-N 91.0859 false true (2-Hydroxypropylperoxy)radical, J3.646.899H IPROPOLO2H OOCC(C)O InChI=1S/C3H8O3/c1-3(4)2-6-5/h3-5H,2H2,1H3 LGTUXDWECPSIQO-UHFFFAOYSA-N 92.0938 false false 98571-42-7, 1-Hydroperoxypropan-2-ol, 2-hydroxypropyl hydroperoxide, DTXSID60564395 IPROPOLPAN O=N(=O)OOC(=O)C(C)O InChI=1S/C3H5NO6/c1-2(5)3(6)9-10-4(7)8/h2,5H,1H3 VGQGEUUGHUVAJJ-UHFFFAOYSA-N 151.0749 false false IPROPOLPER OOC(=O)C(C)O InChI=1S/C3H6O4/c1-2(4)3(5)7-6/h2,4,6H,1H3 LLWVBKQQPPRNEX-UHFFFAOYSA-N 106.0773 false false Propaneperoxoic acid, 2-hydroxy-, 75033-25-9, DTXSID20436822, SCHEMBL5145367, hydroxylactate ISOP34NO3 [O-][N+](=O)OCC(C(=C)C)O InChI=1S/C5H9NO4/c1-4(2)5(7)3-10-6(8)9/h5,7H,1,3H2,2H3 BQDGSYQXOBSWAT-UHFFFAOYSA-N 147.1293 false false ISOP34O CC(=C)C(C[O])O InChI=1S/C5H9O2/c1-4(2)5(7)3-6/h5,7H,1,3H2,2H3 WFOPNBUZMUATLR-UHFFFAOYSA-N 101.1238 false false 2-Isopropenyl-2-hydroxyethoxyradical ISOP34O2 CC(=C)C(CO[O])O InChI=1S/C5H9O3/c1-4(2)5(6)3-8-7/h5-6H,1,3H2,2H3 JEWYKXADRBICPA-UHFFFAOYSA-N 117.1232 false true (2-Hydroxy-3-methyl-3-butenylperoxy)radical ISOP34OOH CC(=C)C(COO)O InChI=1S/C5H10O3/c1-4(2)5(6)3-8-7/h5-7H,1,3H2,2H3 QHTNNTZWVMASKN-UHFFFAOYSA-N 118.1311 false false ISOPANO3 OCC(=CCON(=O)=O)C InChI=1S/C5H9NO4/c1-5(4-7)2-3-10-6(8)9/h2,7H,3-4H2,1H3 ISDFXKLTMWDHJL-UHFFFAOYSA-N 147.1293 false false ISOPAO [O]C/C=C(/CO)C InChI=1S/C5H9O2/c1-5(4-7)2-3-6/h2,7H,3-4H2,1H3/b5-2+ VAGRMNUEVDXLBF-GORDUTHDSA-N 101.1238 false false (3-Methyl-4-hydroxy-2-butenyloxy)radical, [[(2E)-3-Methyl-4-hydroxy-2-butenyl]oxy]radical ISOPAO2 [O]OC/C=C(/CO)C InChI=1S/C5H9O3/c1-5(4-6)2-3-8-7/h2,6H,3-4H2,1H3/b5-2+ HCSTXZLEBYWOKY-GORDUTHDSA-N 117.1232 false true (4-Hydroxy-3-methyl-2-butenylperoxy)radical, [(E)-4-Hydroxy-3-methyl-2-butenylperoxy]radical ISOPAOH OCC=C(C)CO InChI=1S/C5H10O2/c1-5(4-7)2-3-6/h2,6-7H,3-4H2,1H3 FLXLJBCLEUWWCG-UHFFFAOYSA-N 102.1317 false false (Z)-2-METHYLBUT-2-ENE-1,4-DIOL, 2-methylbut-2-ene-1,4-diol, C92111 ISOPAOOH OOCC=C(C)CO InChI=1S/C5H10O3/c1-5(4-6)2-3-8-7/h2,6-7H,3-4H2,1H3 PEJOQVDRQFVMLE-UHFFFAOYSA-N 118.1311 false false ISOPBNO3 OCC(C)(C=C)ON(=O)=O InChI=1S/C5H9NO4/c1-3-5(2,4-7)10-6(8)9/h3,7H,1,4H2,2H3 CIXVZPWFWFMUOH-UHFFFAOYSA-N 147.1293 false false ISOPBO CC([O])(CO)C=C InChI=1S/C5H9O2/c1-3-5(2,7)4-6/h3,6H,1,4H2,2H3 RZIAKDBOUJVNLE-UHFFFAOYSA-N 101.1238 false false 1-Methyl-1-vinyl-2-hydroxyethoxyradical ISOPBO2 OCC(C)(O[O])C=C InChI=1S/C5H9O3/c1-3-5(2,4-6)8-7/h3,6H,1,4H2,2H3 DZGVCPPMSGSRIL-UHFFFAOYSA-N 117.1232 false true (4-Hydroxy-3-methyl-1-butene-3-ylperoxy)radical ISOPBOH CC(O)(CO)C=C InChI=1S/C5H10O2/c1-3-5(2,7)4-6/h3,6-7H,1,4H2,2H3 XZRGYMKUQMPDQH-UHFFFAOYSA-N 102.1317 false false 2-methylbut-3-ene-1,2-diol, 24058-88-6, 2-methyl-3-butene-1,2-diol, 3-Butene-1,2-diol, 2-methyl-, (2r12s)-1,2-dihydroxy-2-methyl-3-butene ISOPBOOH OCC(C)(OO)C=C InChI=1S/C5H10O3/c1-3-5(2,4-6)8-7/h3,6-7H,1,4H2,2H3 QTGGFXPTAQEODO-UHFFFAOYSA-N 118.1311 false false 2-Hydroperoxy-2-methyl-3-buten-1-ol, 2-hydroperoxy-2-methylbut-3-en-1-ol ISOPCNO3 OCC=C(C)CON(=O)=O InChI=1S/C5H9NO4/c1-5(2-3-7)4-10-6(8)9/h2,7H,3-4H2,1H3 IDJHVSOIJITEQU-UHFFFAOYSA-N 147.1293 false false ISOPCO2 [O]OC/C(=C/CO)/C InChI=1S/C5H9O3/c1-5(2-3-6)4-8-7/h2,6H,3-4H2,1H3/b5-2+ IDNPBHCHRRUTQB-GORDUTHDSA-N 117.1232 false true (2-Methyl-4-hydroxy-2-butenylperoxy)radical, [(E)-4-Hydroxy-2-methyl-2-butenylperoxy]radical ISOPCOOH OOCC(=CCO)C InChI=1S/C5H10O3/c1-5(2-3-6)4-8-7/h2,6-7H,3-4H2,1H3 FCLDANRCFPUKED-UHFFFAOYSA-N 118.1311 false false ISOPDNO3 OCC(ON(=O)=O)C(=C)C InChI=1S/C5H9NO4/c1-4(2)5(3-7)10-6(8)9/h5,7H,1,3H2,2H3 PYTOMGVARIWPAT-UHFFFAOYSA-N 147.1293 false false 3-methyl-2-nitrooxy-3-butene-1-ol ISOPDO CC(=C)C([O])CO InChI=1S/C5H9O2/c1-4(2)5(7)3-6/h5-6H,1,3H2,2H3 UZAGXQTTZKOLGQ-UHFFFAOYSA-N 101.1238 false false 1-Isopropenyl-2-hydroxyethoxyradical ISOPDO2 OCC(O[O])C(=C)C InChI=1S/C5H9O3/c1-4(2)5(3-6)8-7/h5-6H,1,3H2,2H3 NZQOVAVEQJALOV-UHFFFAOYSA-N 117.1232 false true (2-Hydroxy-1-isopropenylethylperoxy)radical ISOPDOH CC(=C)C(O)CO InChI=1S/C5H10O2/c1-4(2)5(7)3-6/h5-7H,1,3H2,2H3 HBHXLSPUXXXICF-UHFFFAOYSA-N 102.1317 false false 38585-87-4, 3-methylbut-3-ene-1,2-diol, 3-Butene-1,2-diol, 3-methyl-, 3-Methyl-3-butene-1,2-diol, DTXSID30959451 ISOPDOOH OCC(OO)C(=C)C InChI=1S/C5H10O3/c1-4(2)5(3-6)8-7/h5-7H,1,3H2,2H3 HYHMYONEYJINON-UHFFFAOYSA-N 118.1311 false false 2-Hydroperoxy-3-methyl-3-butene-1-ol, J3.667.231E M3BU3ECO3 CC(=C)CC(=O)O[O] InChI=1S/C5H7O3/c1-4(2)3-5(6)8-7/h1,3H2,2H3 REIAKZYPCUQSBV-UHFFFAOYSA-N 115.1073 false true M3BU3ECO3H CC(=C)CC(=O)OO InChI=1S/C5H8O3/c1-4(2)3-5(6)8-7/h7H,1,3H2,2H3 GTRSDHMQUIGYFW-UHFFFAOYSA-N 116.1152 false false M3BU3EPAN [O-][N+](=O)OOC(=O)CC(=C)C InChI=1S/C5H7NO5/c1-4(2)3-5(7)10-11-6(8)9/h1,3H2,2H3 IFRFLDAEQREFSA-UHFFFAOYSA-N 161.1128 false false M3F Cc1cocc1 InChI=1S/C5H6O/c1-5-2-3-6-4-5/h2-4H,1H3 KJRRQXYWFQKJIP-UHFFFAOYSA-N 82.1005 false false 3-METHYLFURAN, 930-27-8, Furan, 3-methyl-, NSC 346905, NSC-346905 M3FOO O=COC=CC(=[O+][O-])C InChI=1S/C5H6O4/c1-5(9-7)2-3-8-4-6/h2-4H,1H3 FDWUJIBGEDCTQW-UHFFFAOYSA-N 130.0987 false false M3FOOA O=COC=CC(=[O+][O-])C InChI=1S/C5H6O4/c1-5(9-7)2-3-8-4-6/h2-4H,1H3 FDWUJIBGEDCTQW-UHFFFAOYSA-N 130.0987 true false MACO2H CC(=C)C(=O)O InChI=1S/C4H6O2/c1-3(2)4(5)6/h1H2,2H3,(H,5,6) CERQOIWHTDAKMF-UHFFFAOYSA-N 86.0892 false false METHACRYLIC ACID, 79-41-4, 2-Propenoic acid, 2-methyl-, 2-methylprop-2-enoic acid, 2-Methylacrylic acid MACO3 CC(=C)C(=O)O[O] InChI=1S/C4H5O3/c1-3(2)4(5)7-6/h1H2,2H3 DLIMDSINNMMVHE-UHFFFAOYSA-N 101.0807 false true MACO3H CC(=C)C(=O)OO InChI=1S/C4H6O3/c1-3(2)4(5)7-6/h6H,1H2,2H3 OELQSSWXRGADDE-UHFFFAOYSA-N 102.0886 false false 2-Methyl-2-propeneperoxoic acid, SCHEMBL179937, hydroxymethacrylate MACR CC(=C)C=O InChI=1S/C4H6O/c1-4(2)3-5/h3H,1H2,2H3 STNJBCKSHOAVAJ-UHFFFAOYSA-N 70.0898 false false 78-85-3, METHACROLEIN, Methacrylaldehyde, 2-Propenal, 2-methyl-, 2-Methyl-2-propenal MACRNB O=CC(C)(O)CON(=O)=O InChI=1S/C4H7NO5/c1-4(7,2-6)3-10-5(8)9/h2,7H,3H2,1H3 DLZDCWJOERFHAS-UHFFFAOYSA-N 149.1021 false false MACRNBCO2H O=N(=O)OCC(C)(O)C(=O)O InChI=1S/C4H7NO6/c1-4(8,3(6)7)2-11-5(9)10/h8H,2H2,1H3,(H,6,7) WQOIEXBGIWRREH-UHFFFAOYSA-N 165.1015 false false MACRNBCO3 [O]OC(=O)C(C)(O)CON(=O)=O InChI=1S/C4H6NO7/c1-4(7,3(6)12-10)2-11-5(8)9/h7H,2H2,1H3 CSNBCIZHWMXFGH-UHFFFAOYSA-N 180.0929 false true MACRNBCO3H O=N(=O)OCC(C)(O)C(=O)O InChI=1S/C4H7NO6/c1-4(8,3(6)7)2-11-5(9)10/h8H,2H2,1H3,(H,6,7) WQOIEXBGIWRREH-UHFFFAOYSA-N 165.1015 false false MACRNBPAN O=N(=O)OOC(=O)C(C)(O)CON(=O)=O InChI=1S/C4H6N2O9/c1-4(8,2-13-5(9)10)3(7)14-15-6(11)12/h8H,2H2,1H3 HHPQSZXZUAZGAQ-UHFFFAOYSA-N 226.0984 false false MACRNCO2H OCC(C)(ON(=O)=O)C(=O)O InChI=1S/C4H7NO6/c1-4(2-6,3(7)8)11-5(9)10/h6H,2H2,1H3,(H,7,8) GPIMHHNLFCYMAO-UHFFFAOYSA-N 165.1015 false false MACRNCO3 [O]OC(=O)C(C)(CO)ON(=O)=O InChI=1S/C4H6NO7/c1-4(2-6,3(7)11-10)12-5(8)9/h6H,2H2,1H3 RWPAECNMNLCFDT-UHFFFAOYSA-N 180.0929 false true MACRNCO3H OOC(=O)C(C)(CO)ON(=O)=O InChI=1S/C4H7NO7/c1-4(2-6,3(7)11-10)12-5(8)9/h6,10H,2H2,1H3 VCAMMMQHKHRNFT-UHFFFAOYSA-N 181.1009 false false MACRNO3 OCC(C)(C=O)ON(=O)=O InChI=1S/C4H7NO5/c1-4(2-6,3-7)10-5(8)9/h2,7H,3H2,1H3 ALINXPRBVMXOGH-UHFFFAOYSA-N 149.1021 false false MACRNOO [O-][O+]=CC(C)(CO)ON(=O)=O InChI=1S/C4H7NO6/c1-4(2-6,3-10-9)11-5(7)8/h3,6H,2H2,1H3 CKWZSGQMSJRVMK-UHFFFAOYSA-N 165.1015 false false MACRNOOA [O-][O+]=CC(C)(CO)ON(=O)=O InChI=1S/C4H7NO6/c1-4(2-6,3-10-9)11-5(7)8/h3,6H,2H2,1H3 CKWZSGQMSJRVMK-UHFFFAOYSA-N 165.1015 true false MACRNPAN OCC(C)(ON(=O)=O)C(=O)OON(=O)=O InChI=1S/C4H6N2O9/c1-4(2-7,14-5(9)10)3(8)13-15-6(11)12/h7H,2H2,1H3 YVNHVFURNFQJQM-UHFFFAOYSA-N 226.0984 false false MACRO CC([O])(CO)C=O InChI=1S/C4H7O3/c1-4(7,2-5)3-6/h2,6H,3H2,1H3 KRGANXMUBQVFEY-UHFFFAOYSA-N 103.0966 false false MACRO2 OCC(C)(O[O])C=O InChI=1S/C4H7O4/c1-4(2-5,3-6)8-7/h2,6H,3H2,1H3 VXPZASQQDXRJKS-UHFFFAOYSA-N 119.096 false true [(1-Oxo-3-hydroxy-2-methylpropane-2-yl)peroxy]radical MACROH CC(O)(CO)C=O InChI=1S/C4H8O3/c1-4(7,2-5)3-6/h2,6-7H,3H2,1H3 JBCPUXACCOWZEB-UHFFFAOYSA-N 104.1045 false false SCHEMBL17350687, alpha-Methylglycerinaldehyd MACROHO CC(O)(C[O])C=O InChI=1S/C4H7O3/c1-4(7,2-5)3-6/h2,7H,3H2,1H3 HWJPMXXDFOZUQR-UHFFFAOYSA-N 103.0966 false false MACROHO2 CC(O)(CO[O])C=O InChI=1S/C4H7O4/c1-4(6,2-5)3-8-7/h2,6H,3H2,1H3 NQYYTROOWWRYDV-UHFFFAOYSA-N 119.096 false true [(3-Oxo-2-hydroxy-2-methylpropyl)peroxy]radical MACROHOOH CC(O)(COO)C=O InChI=1S/C4H8O4/c1-4(6,2-5)3-8-7/h2,6-7H,3H2,1H3 HWQXXVVDRNBYQB-UHFFFAOYSA-N 120.1039 false false MACROO [O-][O+]=CC(=C)C InChI=1S/C4H6O2/c1-4(2)3-6-5/h3H,1H2,2H3 MISZXPHZEJTKFD-UHFFFAOYSA-N 86.0892 false false 2-Methyl-4,5-dioxa-1-pentene-3,5-diylradical, 3-Methyl-1-oxa-1,3-butadiene1-oxide MACROOA [O-][O+]=CC(=C)C InChI=1S/C4H6O2/c1-4(2)3-6-5/h3H,1H2,2H3 MISZXPHZEJTKFD-UHFFFAOYSA-N 86.0892 true false 2-Methyl-4,5-dioxa-1-pentene-3,5-diylradical, 3-Methyl-1-oxa-1,3-butadiene1-oxide MACROOH OCC(C)(OO)C=O InChI=1S/C4H8O4/c1-4(2-5,3-6)8-7/h2,6-7H,3H2,1H3 MOSGWPXPTZVSII-UHFFFAOYSA-N 120.1039 false false MAE CC1(CO1)C(=O)O InChI=1S/C4H6O3/c1-4(2-7-4)3(5)6/h2H2,1H3,(H,5,6) CSEUSVYSDPXJAP-UHFFFAOYSA-N 102.0886 false false 38649-35-3, 2-methyloxirane-2-carboxylic Acid, 2-Methyl-oxirane-2-carboxylic acid, AKOS006273114, AT28392 MC3CODBCO2 O=CC=C(C)C(=O)[O] InChI=1S/C5H5O3/c1-4(2-3-6)5(7)8/h2-3H,1H3 IJJDRMALOZCWPD-UHFFFAOYSA-N 113.0914 false false MC3CODBCO3 CC(=CC=O)C(=O)O[O] InChI=1S/C5H5O4/c1-4(2-3-6)5(7)9-8/h2-3H,1H3 MKAADYZNDGDKBV-UHFFFAOYSA-N 129.0908 false true MC3CODBPAN O=CC=C(C)C(=O)OON(=O)=O InChI=1S/C5H5NO6/c1-4(2-3-7)5(8)11-12-6(9)10/h2-3H,1H3 AENWJVOXGCGHKR-UHFFFAOYSA-N 175.0963 false false MC3ODBCO2H O=CC=C(C)C(=O)O InChI=1S/C5H6O3/c1-4(2-3-6)5(7)8/h2-3H,1H3,(H,7,8) QPFVAKLVWFPTSX-UHFFFAOYSA-N 114.0993 false false 63170-47-8, 2-methyl-4-oxobut-2-enoic acid, 2methyl-4-oxobut-2-enoic acid, DTXSID40705800, SCHEMBL1825208 MCOCOMOOOH CC(=O)C(=O)OCOO InChI=1S/C4H6O5/c1-3(5)4(6)8-2-9-7/h7H,2H2,1H3 BJTKGFWDIAZUGI-UHFFFAOYSA-N 134.0874 false false MCOCOMOXO CC(=O)C(=O)OC[O] InChI=1S/C4H5O4/c1-3(6)4(7)8-2-5/h2H2,1H3 ACSXOLKGDVMJLE-UHFFFAOYSA-N 117.0801 false false MCOCOMOXO2 CC(=O)C(=O)OCO[O] InChI=1S/C4H5O5/c1-3(5)4(6)8-2-9-7/h2H2,1H3 ACQLXZWPSCVPAP-UHFFFAOYSA-N 133.0795 false true ME3BU3ECHO CC(=C)CC=O InChI=1S/C5H8O/c1-5(2)3-4-6/h4H,1,3H2,2H3 VEEFADFWCHSFIU-UHFFFAOYSA-N 84.1164 false false 1118-59-8, 3-METHYL-3-BUTENAL, 3-Butenal, 3-methyl-, 3-methylbut-3-enal, 3-methyl-3-buten-1-al MGLOO [O-][O+]=CC(=O)C InChI=1S/C3H4O3/c1-3(4)2-6-5/h2H,1H3 WGCYMRSXNMXSPV-UHFFFAOYSA-N 88.0621 false false MGLOOA [O-][O+]=CC(=O)C InChI=1S/C3H4O3/c1-3(4)2-6-5/h2H,1H3 WGCYMRSXNMXSPV-UHFFFAOYSA-N 88.0621 true false MGLYOO [O-][O+]=C(C)C=O InChI=1S/C3H4O3/c1-3(2-4)6-5/h2H,1H3 HTWYOLXDLBXZDG-UHFFFAOYSA-N 88.0621 false false MGLYOOA [O-][O+]=C(C)C=O InChI=1S/C3H4O3/c1-3(2-4)6-5/h2H,1H3 HTWYOLXDLBXZDG-UHFFFAOYSA-N 88.0621 true false MGLYOOB [O-][O+]=C(C)C=O InChI=1S/C3H4O3/c1-3(2-4)6-5/h2H,1H3 HTWYOLXDLBXZDG-UHFFFAOYSA-N 88.0621 true false MGLYOX O=CC(=O)C InChI=1S/C3H4O2/c1-3(5)2-4/h2H,1H3 AIJULSRZWUXGPQ-UHFFFAOYSA-N 72.0627 false false 78-98-8, methylglyoxal, 2-Oxopropanal, pyruvic aldehyde, pyruvaldehyde MMALANHY O=C1C=C(C)C(=O)O1 InChI=1S/C5H4O3/c1-3-2-4(6)8-5(3)7/h2H,1H3 AYKYXWQEBUNJCN-UHFFFAOYSA-N 112.0835 false false 616-02-4, Citraconic anhydride, 3-methylfuran-2,5-dione, 2,5-Furandione, 3-methyl-, 2-Methylmaleic anhydride MMALANHYO O=C1OC(=O)C(C)([O])C1O InChI=1S/C5H5O5/c1-5(9)2(6)3(7)10-4(5)8/h2,6H,1H3 VLOVQFKBQLWMFZ-UHFFFAOYSA-N 145.0902 false false MMALANHYO2 CC1(O[O])C(O)C(=O)OC1=O InChI=1S/C5H5O6/c1-5(11-9)2(6)3(7)10-4(5)8/h2,6H,1H3 NGPNVSIILLEWPP-UHFFFAOYSA-N 161.0896 false true MMALNACO2H O=CC(C)(ON(=O)=O)C(O)C(=O)O InChI=1S/C5H7NO7/c1-5(2-7,13-6(11)12)3(8)4(9)10/h2-3,8H,1H3,(H,9,10) REHIBMNEJUPYOU-UHFFFAOYSA-N 193.1116 false false MMALNACO3 [O]OC(=O)C(O)C(C)(C=O)ON(=O)=O InChI=1S/C5H6NO8/c1-5(2-7,14-6(10)11)3(8)4(9)13-12/h2-3,8H,1H3 AQYJAYPPQACXMX-UHFFFAOYSA-N 208.103 false true MMALNACO3H OOC(=O)C(O)C(C)(C=O)ON(=O)=O InChI=1S/C5H7NO8/c1-5(2-7,14-6(10)11)3(8)4(9)13-12/h2-3,8,12H,1H3 WWJYGONDDIBFHK-UHFFFAOYSA-N 209.111 false false MMALNAPAN O=CC(C)(ON(=O)=O)C(O)C(=O)OON(=O)=O InChI=1S/C5H6N2O10/c1-5(2-8,16-6(11)12)3(9)4(10)15-17-7(13)14/h2-3,9H,1H3 JNHZFZYBXYVXPX-UHFFFAOYSA-N 254.1085 false false MMALNBCO2H O=CC(O)C(C)(ON(=O)=O)C(=O)O InChI=1S/C5H7NO7/c1-5(4(9)10,3(8)2-7)13-6(11)12/h2-3,8H,1H3,(H,9,10) RAMGTVAYJVLLRG-UHFFFAOYSA-N 193.1116 false false MMALNBCO3 O=CC(O)C(C)(ON(=O)=O)C(=O)O[O] InChI=1S/C5H6NO8/c1-5(3(8)2-7,4(9)13-12)14-6(10)11/h2-3,8H,1H3 KUFNXMZQEBCVJS-UHFFFAOYSA-N 208.103 false true MMALNBCO3H O=CC(O)C(C)(ON(=O)=O)C(=O)OO InChI=1S/C5H7NO8/c1-5(3(8)2-7,4(9)13-12)14-6(10)11/h2-3,8,12H,1H3 ASZGKTQVJXPLHM-UHFFFAOYSA-N 209.111 false false MMALNBPAN O=CC(O)C(C)(ON(=O)=O)C(=O)OON(=O)=O InChI=1S/C5H6N2O10/c1-5(3(9)2-8,16-6(11)12)4(10)15-17-7(13)14/h2-3,9H,1H3 QNDDWZGVLTYMIK-UHFFFAOYSA-N 254.1085 false false MMALNHY2OH O=C1OC(=O)C(C)(O)C1O InChI=1S/C5H6O5/c1-5(9)2(6)3(7)10-4(5)8/h2,6,9H,1H3 DGWWNMWYNUWPBC-UHFFFAOYSA-N 146.0981 false false MMALNHYOOH CC1(OO)C(O)C(=O)OC1=O InChI=1S/C5H6O6/c1-5(11-9)2(6)3(7)10-4(5)8/h2,6,9H,1H3 JNCHKPBVXWMPAJ-UHFFFAOYSA-N 162.0975 false false MPAN O=N(=O)OOC(=O)C(=C)C InChI=1S/C4H5NO5/c1-3(2)4(6)9-10-5(7)8/h1H2,2H3 LLZWPQFQEBKRLX-UHFFFAOYSA-N 147.0862 false false Peroxide, 2-methyl-1-oxo-2-propenyl nitro, 88181-75-3, DTXSID10236878, Peroxy methacryloyl nitrate, methacryloyl peroxynitrate MVK CC(=O)C=C InChI=1S/C4H6O/c1-3-4(2)5/h3H,1H2,2H3 FUSUHKVFWTUUBE-UHFFFAOYSA-N 70.0898 false false 78-94-4, METHYL VINYL KETONE, methyl-vinyl-ketone, 3-Buten-2-one, but-3-en-2-one MVKNO3 OCC(ON(=O)=O)C(=O)C InChI=1S/C4H7NO5/c1-3(7)4(2-6)10-5(8)9/h4,6H,2H2,1H3 SCJOQBCZNBCTOQ-UHFFFAOYSA-N 149.1021 false false MVKO [O]CC(=O)C=C InChI=1S/C4H5O2/c1-2-4(6)3-5/h2H,1,3H2 YZYIHNNHDLRYHA-UHFFFAOYSA-N 85.0813 false false MVKO2 [O]OCC(=O)C=C InChI=1S/C4H5O3/c1-2-4(5)3-7-6/h2H,1,3H2 ANUKDEIWINIDKD-UHFFFAOYSA-N 101.0807 false true MVKOH OCC(=O)C=C InChI=1S/C4H6O2/c1-2-4(6)3-5/h2,5H,1,3H2 LHBQGXZUVXFJRH-UHFFFAOYSA-N 86.0892 false false 52642-66-7, 1-hydroxybut-3-en-2-one, hydroxymethylvinyl ketone, (Hydroxymethyl)vinyl ketone, DTXSID10494754 MVKOHANO3 OCC(=O)C(O)CON(=O)=O InChI=1S/C4H7NO6/c6-1-3(7)4(8)2-11-5(9)10/h4,6,8H,1-2H2 DMSMZXCVKMBQGA-UHFFFAOYSA-N 165.1015 false false MVKOHAO OCC(=O)C(O)C[O] InChI=1S/C4H7O4/c5-1-3(7)4(8)2-6/h3,6-7H,1-2H2 ITTHIFYUVDSWQQ-UHFFFAOYSA-N 119.096 false false MVKOHAO2 [O]OCC(O)C(=O)CO InChI=1S/C4H7O5/c5-1-3(6)4(7)2-9-8/h4-5,7H,1-2H2 WWWSQZDOUOQUKT-UHFFFAOYSA-N 135.0954 false true MVKOHAOH OCC(=O)C(O)CO InChI=1S/C4H8O4/c5-1-3(7)4(8)2-6/h3,5-7H,1-2H2 UQPHVQVXLPRNCX-UHFFFAOYSA-N 120.1039 false false Erythrulose, 1,3,4-trihydroxybutan-2-one, 40031-31-0, glycero-tetrulose, 1,3,4-trihydroxy-2-butanone MVKOHAOOH OOCC(O)C(=O)CO InChI=1S/C4H8O5/c5-1-3(6)4(7)2-9-8/h4-5,7-8H,1-2H2 MOVXURHCNUWOQO-UHFFFAOYSA-N 136.1033 false false MVKOHBO OCC(=O)C([O])CO InChI=1S/C4H7O4/c5-1-3(7)4(8)2-6/h3,5-6H,1-2H2 BLWPMPWUYWIMPH-UHFFFAOYSA-N 119.096 false false MVKOHBO2 OCC(=O)C(CO)O[O] InChI=1S/C4H7O5/c5-1-3(7)4(2-6)9-8/h4-6H,1-2H2 DQRYFWIHWVVMQU-UHFFFAOYSA-N 135.0954 false true MVKOHBOOH OCC(=O)C(CO)OO InChI=1S/C4H8O5/c5-1-3(7)4(2-6)9-8/h4-6,8H,1-2H2 WSMWIMXDHMPHIN-UHFFFAOYSA-N 136.1033 false false MVKOO [O-][O+]=C(C)C=C InChI=1S/C4H6O2/c1-3-4(2)6-5/h3H,1H2,2H3 WHIGGEYDDWFYON-UHFFFAOYSA-N 86.0892 false false 3-Methyl-4,5-dioxa-1-pentene-3,5-diylradical, Methylvinylformaldehyde 2-oxide MVKOOA [O-][O+]=C(C)C=C InChI=1S/C4H6O2/c1-3-4(2)6-5/h3H,1H2,2H3 WHIGGEYDDWFYON-UHFFFAOYSA-N 86.0892 true false 3-Methyl-4,5-dioxa-1-pentene-3,5-diylradical, Methylvinylformaldehyde 2-oxide MVKOOH OOCC(=O)C=C InChI=1S/C4H6O3/c1-2-4(5)3-7-6/h2,6H,1,3H2 PRFKYXWFQJOCGY-UHFFFAOYSA-N 102.0886 false false N2O5 NA NC2OO [O-][O+]=CCON(=O)=O InChI=1S/C2H3NO5/c4-3(5)7-1-2-8-6/h2H,1H2 CIPNPALEKUNKSZ-UHFFFAOYSA-N 121.0489 false false NC2OOA [O-][O+]=CCON(=O)=O InChI=1S/C2H3NO5/c4-3(5)7-1-2-8-6/h2H,1H2 CIPNPALEKUNKSZ-UHFFFAOYSA-N 121.0489 true false NC3OO [O-][O+]=C(C)CON(=O)=O InChI=1S/C3H5NO5/c1-3(9-7)2-8-4(5)6/h2H2,1H3 ASEQZBXHAFIYRQ-UHFFFAOYSA-N 135.0755 false false NC3OOA [O-][O+]=C(C)CON(=O)=O InChI=1S/C3H5NO5/c1-3(9-7)2-8-4(5)6/h2H2,1H3 ASEQZBXHAFIYRQ-UHFFFAOYSA-N 135.0755 true false NC41OO OC(C(=[O+][O-])C)CON(=O)=O InChI=1S/C4H7NO6/c1-3(11-9)4(6)2-10-5(7)8/h4,6H,2H2,1H3 BCXCELUSGLJQHA-UHFFFAOYSA-N 165.1015 false false NC41OOA OC(C(=[O+][O-])C)CON(=O)=O InChI=1S/C4H7NO6/c1-3(11-9)4(6)2-10-5(7)8/h4,6H,2H2,1H3 BCXCELUSGLJQHA-UHFFFAOYSA-N 165.1015 true false NC4CHO O=CC=C(C)CON(=O)=O InChI=1S/C5H7NO4/c1-5(2-3-7)4-10-6(8)9/h2-3H,4H2,1H3 FHQODWHGFJXLCS-UHFFFAOYSA-N 145.1134 false false 3-Methyl-4-nitroxy-2-butenal NC4CO2H O=N(=O)OCC(=CC(=O)O)C InChI=1S/C5H7NO5/c1-4(2-5(7)8)3-11-6(9)10/h2H,3H2,1H3,(H,7,8) ZKTRJZJYWMAEEY-UHFFFAOYSA-N 161.1128 false false NC4CO3 [O]OC(=O)C=C(C)CON(=O)=O InChI=1S/C5H6NO6/c1-4(2-5(7)12-10)3-11-6(8)9/h2H,3H2,1H3 LDRABOXGZZRONS-UHFFFAOYSA-N 176.1042 false true NC4CO3H OOC(=O)C=C(C)CON(=O)=O InChI=1S/C5H7NO6/c1-4(2-5(7)12-10)3-11-6(8)9/h2,10H,3H2,1H3 SLKHOLOIOGBFQB-UHFFFAOYSA-N 177.1122 false false NC4OO OCC(ON(=O)=O)C(=[O+][O-])C InChI=1S/C4H7NO6/c1-3(11-9)4(2-6)10-5(7)8/h4,6H,2H2,1H3 FFTLLNVSVCCJCV-UHFFFAOYSA-N 165.1015 false false NC4OOA OCC(ON(=O)=O)C(=[O+][O-])C InChI=1S/C4H7NO6/c1-3(11-9)4(2-6)10-5(7)8/h4,6H,2H2,1H3 FFTLLNVSVCCJCV-UHFFFAOYSA-N 165.1015 true false NC51O [O]C(CC(=O)C)CO[N+](=O)[O-] InChI=1S/C5H8NO5/c1-4(7)2-5(8)3-11-6(9)10/h5H,2-3H2,1H3 LEVDRUDCFPXFOE-UHFFFAOYSA-N 162.1207 false false NC51O2 [O]OC(CC(=O)C)CO[N+](=O)[O-] InChI=1S/C5H8NO6/c1-4(7)2-5(12-10)3-11-6(8)9/h5H,2-3H2,1H3 QXCZPKCRNWRQQH-UHFFFAOYSA-N 178.1201 false true NC51OOH OOC(CC(=O)C)CO[N+](=O)[O-] InChI=1S/C5H9NO6/c1-4(7)2-5(12-10)3-11-6(8)9/h5,10H,2-3H2,1H3 HENPBPZCVUBLOK-UHFFFAOYSA-N 179.1281 false false NC524NO3 OCC(ON(=O)=O)C(CO)(CO)ON(=O)=O InChI=1S/C5H10N2O9/c8-1-4(15-6(11)12)5(2-9,3-10)16-7(13)14/h4,8-10H,1-3H2 NSZZUBPWOYNZJW-UHFFFAOYSA-N 242.1409 false false NC524O OCC(ON(=O)=O)C([O])(CO)CO InChI=1S/C5H10NO7/c7-1-4(13-6(11)12)5(10,2-8)3-9/h4,7-9H,1-3H2 SXANVVCJHMXKBQ-UHFFFAOYSA-N 196.1354 false false NC524O2 OCC(ON(=O)=O)C(CO)(CO)O[O] InChI=1S/C5H10NO8/c7-1-4(13-6(10)11)5(2-8,3-9)14-12/h4,7-9H,1-3H2 MPCBQALINXBVNJ-UHFFFAOYSA-N 212.1348 false true NC524OH OCC(ON(=O)=O)C(O)(CO)CO InChI=1S/C5H11NO7/c7-1-4(13-6(11)12)5(10,2-8)3-9/h4,7-10H,1-3H2 ZZGZKDXCMVGDSK-UHFFFAOYSA-N 197.1433 false false NC524OOH OCC(ON(=O)=O)C(CO)(CO)OO InChI=1S/C5H11NO8/c7-1-4(13-6(10)11)5(2-8,3-9)14-12/h4,7-9,12H,1-3H2 IVLBZHUBMDVGDP-UHFFFAOYSA-N 213.1427 false false NC526O O=CCC(CO[N+](=O)[O-])([O])C InChI=1S/C5H8NO5/c1-5(8,2-3-7)4-11-6(9)10/h3H,2,4H2,1H3 MJNGDUOCOQFEAM-UHFFFAOYSA-N 162.1207 false false NC526O2 O=CCC(CO[N+](=O)[O-])(O[O])C InChI=1S/C5H8NO6/c1-5(12-10,2-3-7)4-11-6(8)9/h3H,2,4H2,1H3 FIMRJONRWCKROL-UHFFFAOYSA-N 178.1201 false true NC526OOH O=CCC(CO[N+](=O)[O-])(OO)C InChI=1S/C5H9NO6/c1-5(12-10,2-3-7)4-11-6(8)9/h3,10H,2,4H2,1H3 MAJLHONLFNONRE-UHFFFAOYSA-N 179.1281 false false NISOPNO3 CC(=CCON(=O)=O)CON(=O)=O InChI=1S/C5H8N2O6/c1-5(4-13-7(10)11)2-3-12-6(8)9/h2H,3-4H2,1H3 JGJBVRGABXKDRR-UHFFFAOYSA-N 192.1268 false false NISOPO [O]CC=C(C)CON(=O)=O InChI=1S/C5H8NO4/c1-5(2-3-7)4-10-6(8)9/h2H,3-4H2,1H3 NNFYTWGZHXLIPO-UHFFFAOYSA-N 146.1213 false false NISOPO2 [O]OCC=C(C)CON(=O)=O InChI=1S/C5H8NO5/c1-5(2-3-11-9)4-10-6(7)8/h2H,3-4H2,1H3 QURPJIPTHSWPNM-UHFFFAOYSA-N 162.1207 false true NISOPOOH OOCC=C(C)CON(=O)=O InChI=1S/C5H9NO5/c1-5(2-3-11-9)4-10-6(7)8/h2,9H,3-4H2,1H3 IRFXVIPRKCCSLU-UHFFFAOYSA-N 163.1287 false false NMGLYOX O=CC(=O)CON(=O)=O InChI=1S/C3H3NO5/c5-1-3(6)2-9-4(7)8/h1H,2H2 OPXOPVKLHYDIMX-UHFFFAOYSA-N 133.0596 false false NO NO2 NO3 NO3CH2CHO O=CCON(=O)=O InChI=1S/C2H3NO4/c4-1-2-7-3(5)6/h1H,2H2 ABUBKAMLUVOXSP-UHFFFAOYSA-N 105.0495 false false SCHEMBL15406243, nitroxy ethanal NO3CH2CO2H OC(=O)CON(=O)=O InChI=1S/C2H3NO5/c4-2(5)1-8-3(6)7/h1H2,(H,4,5) VHOVOPOBBVJMEP-UHFFFAOYSA-N 121.0489 false false AKOS006378219, SCHEMBL456770, carboxymethyl nitrate NO3CH2CO3 [O]OC(=O)CON(=O)=O InChI=1S/C2H2NO6/c4-2(9-7)1-8-3(5)6/h1H2 FLILNVCFQRJRDL-UHFFFAOYSA-N 136.0404 false true NO3CH2CO3H OOC(=O)CON(=O)=O InChI=1S/C2H3NO6/c4-2(9-7)1-8-3(5)6/h7H,1H2 VLCOOHYMNNDETJ-UHFFFAOYSA-N 137.0483 false false NO3CH2PAN O=C(CON(=O)=O)OON(=O)=O InChI=1S/C2H2N2O8/c5-2(1-10-3(6)7)11-12-4(8)9/h1H2 CSNUPQYBRZIENU-UHFFFAOYSA-N 182.0459 false false NOA CC(=O)CON(=O)=O InChI=1S/C3H5NO4/c1-3(5)2-8-4(6)7/h2H2,1H3 ISWXYJQANHQYSR-UHFFFAOYSA-N 119.0761 false false 2-Propanone, 1-(nitrooxy)-, 6745-71-7, 2-oxopropyl nitrate, 2-Propanone, 1-hydroxy-, nitrate, 1-Hydroxy-2-propanone nitrate NOAOO [O-][O+]=C(C)CON(=O)=O InChI=1S/C3H5NO5/c1-3(9-7)2-8-4(5)6/h2H2,1H3 ASEQZBXHAFIYRQ-UHFFFAOYSA-N 135.0755 false false NOAOOA [O-][O+]=C(C)CON(=O)=O InChI=1S/C3H5NO5/c1-3(9-7)2-8-4(5)6/h2H2,1H3 ASEQZBXHAFIYRQ-UHFFFAOYSA-N 135.0755 true false NPXYFUO O=N(=O)OC1COC(=O)C1(C)[O] InChI=1S/C5H6NO6/c1-5(8)3(12-6(9)10)2-11-4(5)7/h3H,2H2,1H3 CEKZUIXKXYZCOT-UHFFFAOYSA-N 176.1042 false false NPXYFUO2 [O]OC1(C)C(=O)OCC1ON(=O)=O InChI=1S/C5H6NO7/c1-5(13-10)3(12-6(8)9)2-11-4(5)7/h3H,2H2,1H3 AMZQIHBGRSDLDW-UHFFFAOYSA-N 192.1036 false true NPXYFUOOH OOC1(C)C(=O)OCC1ON(=O)=O InChI=1S/C5H7NO7/c1-5(13-10)3(12-6(8)9)2-11-4(5)7/h3,10H,2H2,1H3 ARRSNVVNYKGUFK-UHFFFAOYSA-N 193.1116 false false O O1D O3 OCCOHCO OC(C[O])C=O InChI=1S/C3H5O3/c4-1-3(6)2-5/h1,3,6H,2H2 UYFVYXMONRTKOM-UHFFFAOYSA-N 89.07 false false OCCOHCO2 OC(CO[O])C=O InChI=1S/C3H5O4/c4-1-3(5)2-7-6/h1,3,5H,2H2 CWRVTWJLBDTBQZ-UHFFFAOYSA-N 105.0694 false true OCCOHCOH OC(CO)C=O InChI=1S/C3H6O3/c4-1-3(6)2-5/h1,3,5-6H,2H2 MNQZXJOMYWMBOU-UHFFFAOYSA-N 90.0779 false false 56-82-6, DL-Glyceraldehyde, (+-)-glyceraldehyde, glyceraldehyde, 2,3-Dihydroxypropanal OCCOHCOOH OC(COO)C=O InChI=1S/C3H6O4/c4-1-3(5)2-7-6/h1,3,5-6H,2H2 UFAXCNDNIIDPQE-UHFFFAOYSA-N 106.0773 false false OH PACLOOA [O-][O+]=C(COO)C InChI=1S/C3H6O4/c1-3(7-5)2-6-4/h4H,2H2,1H3 MXLFZKUPYZMGEK-UHFFFAOYSA-N 106.0773 true false PAN CC(=O)OON(=O)=O InChI=1S/C2H3NO5/c1-2(4)7-8-3(5)6/h1H3 VGQXTTSVLMQFHM-UHFFFAOYSA-N 121.0489 false false Peroxyacetyl nitrate, 2278-22-0, Peroxide, acetyl nitro, BRN 1906650, CCRIS 5298 PE4E2CO CC(=O)CC=C InChI=1S/C5H8O/c1-3-4-5(2)6/h3H,1,4H2,2H3 PNJWIWWMYCMZRO-UHFFFAOYSA-N 84.1164 false false 4-Penten-2-one, 13891-87-7, pent-4-en-2-one, Allyl methyl ketone, 4CUM84CQ9J PGAOOB [O-][O+]=CCOO InChI=1S/C2H4O4/c3-5-1-2-6-4/h1,4H,2H2 FOIHGCYLGZTDHQ-UHFFFAOYSA-N 92.0508 true false PHAN OCC(=O)OON(=O)=O InChI=1S/C2H3NO6/c4-1-2(5)8-9-3(6)7/h4H,1H2 KMDWHTZYVJXWAH-UHFFFAOYSA-N 137.0483 false false 107223-28-9, Ethanol, 2-(nitrodioxy)-2-oxo-, DTXSID50147959, glycolic acid nitrate PPACLOOA [O-][O+]=C(C(=O)OO)C InChI=1S/C3H4O5/c1-2(7-5)3(4)8-6/h6H,1H3 WOFPSSCSKHXRBS-UHFFFAOYSA-N 120.0609 true false PPGAOOB [O-][O+]=CC(=O)OO InChI=1S/C2H2O5/c3-2(7-5)1-6-4/h1,5H CNIPYRNMAXNOOL-UHFFFAOYSA-N 106.0343 true false PR1O2HNO3 OOCC(C)ON(=O)=O InChI=1S/C3H7NO5/c1-3(2-8-7)9-4(5)6/h3,7H,2H2,1H3 FROUFTMXOYPVCX-UHFFFAOYSA-N 137.0914 false false PR2O2HNO3 OOC(C)CON(=O)=O InChI=1S/C3H7NO5/c1-3(9-7)2-8-4(5)6/h3,7H,2H2,1H3 UHIVGIHVGRYUPL-UHFFFAOYSA-N 137.0914 false false PRNO3CO2H O=N(=O)OC(C)C(=O)O InChI=1S/C3H5NO5/c1-2(3(5)6)9-4(7)8/h2H,1H3,(H,5,6) DVOPCQDTEPKYKW-UHFFFAOYSA-N 135.0755 false false 1860-18-0, 2-(Nitrooxy)propanoic acid, AKOS006377427, DTXSID70579516, SCHEMBL2013129 PRNO3CO3 [O]OC(=O)C(C)ON(=O)=O InChI=1S/C3H4NO6/c1-2(3(5)10-8)9-4(6)7/h2H,1H3 UMRHAZWHGVZYIQ-UHFFFAOYSA-N 150.067 false true PRNO3CO3H OOC(=O)C(C)ON(=O)=O InChI=1S/C3H5NO6/c1-2(3(5)10-8)9-4(6)7/h2,8H,1H3 FMRKJWQAPYMRJD-UHFFFAOYSA-N 151.0749 false false PRNO3PAN O=N(=O)OOC(=O)C(C)ON(=O)=O InChI=1S/C3H4N2O8/c1-2(11-4(7)8)3(6)12-13-5(9)10/h2H,1H3 ZLJYZUGEJFPONP-UHFFFAOYSA-N 196.0725 false false PROLNO3 CC(O)CON(=O)=O InChI=1S/C3H7NO4/c1-3(5)2-8-4(6)7/h3,5H,2H2,1H3 OMDFJTSKBNDDRM-UHFFFAOYSA-N 121.092 false false 1,2-Propanediol, 1-nitrate, 1,2-Propanediol, 1-nitrate-, 20266-65-3, 1-(Nitrooxy)-2-propanol, 2-hy-droxypropyl nitrate PRONO3AO [O]CC(C)ON(=O)=O InChI=1S/C3H6NO4/c1-3(2-5)8-4(6)7/h3H,2H2,1H3 BERXLGZUFBOFNY-UHFFFAOYSA-N 120.084 false false PRONO3AO2 [O]OCC(C)ON(=O)=O InChI=1S/C3H6NO5/c1-3(2-8-7)9-4(5)6/h3H,2H2,1H3 NHCJDKHDUHQTGU-UHFFFAOYSA-N 136.0834 false true PRONO3BO CC([O])CON(=O)=O InChI=1S/C3H6NO4/c1-3(5)2-8-4(6)7/h3H,2H2,1H3 DIOSGKQTPVXGLS-UHFFFAOYSA-N 120.084 false false PRONO3BO2 [O]OC(C)CON(=O)=O InChI=1S/C3H6NO5/c1-3(9-7)2-8-4(5)6/h3H,2H2,1H3 JCOYRDPIGGLMIV-UHFFFAOYSA-N 136.0834 false true PROPALO CC([O])C=O InChI=1S/C3H5O2/c1-3(5)2-4/h2-3H,1H3 FDESTMBVYKKMHY-UHFFFAOYSA-N 73.0706 false false (1-Methyl-2-oxoethoxy)radical PROPGLY OCC(C)O InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3 DNIAPMSPPWPWGF-UHFFFAOYSA-N 76.0944 false false (+-)-Propylene glycol, propylene glycol, propylene-glycol, 57-55-6, (+-)-1,2-Propanediol PROPOLNO3 OCC(C)ON(=O)=O InChI=1S/C3H7NO4/c1-3(2-5)8-4(6)7/h3,5H,2H2,1H3 HGCMMKIIGJXXMW-UHFFFAOYSA-N 121.092 false false 1,2-Propanediol, 2-nitrate, 20266-74-4, 1-hydroxypropan-2-yl nitrate, 2-nitrooxy-1-propanol, DTXSID70873561 PXYFUO CC1([O])C(O)COC1=O InChI=1S/C5H7O4/c1-5(8)3(6)2-9-4(5)7/h3,6H,2H2,1H3 KCIXVIGLCMVYKA-UHFFFAOYSA-N 131.1067 false false PXYFUO2 [O]OC1(C)C(O)COC1=O InChI=1S/C5H7O5/c1-5(10-8)3(6)2-9-4(5)7/h3,6H,2H2,1H3 AFMLDMNPTRJIAN-UHFFFAOYSA-N 147.1061 false true PXYFUOH CC1(O)C(O)COC1=O InChI=1S/C5H8O4/c1-5(8)3(6)2-9-4(5)7/h3,6,8H,2H2,1H3 OHTGZAWPVDWARE-UHFFFAOYSA-N 132.1146 false false 2-C-Methyl-1,4-erythrono-D-lactone, 3,4-dihydroxy-3-methyloxolan-2-one, 63700-30-1, 2(3H)-Furanone, dihydro-3,4-dihydroxy-3-methyl-, 2,3,4-Trihydroxy-2-methylbutanoic acid gamma-lactone PXYFUONE O=C1OCC=C1C InChI=1S/C5H6O2/c1-4-2-3-7-5(4)6/h2H,3H2,1H3 VGHBEMPMIVEGJP-UHFFFAOYSA-N 98.0999 false false 22122-36-7, 3-Methyl-2(5H)-furanone, 3-Methylfuran-2(5H)-one, 2(5H)-Furanone, 3-methyl-, 4-methyl-2H-furan-5-one PXYFUOOH OOC1(C)C(O)COC1=O InChI=1S/C5H8O5/c1-5(10-8)3(6)2-9-4(5)7/h3,6,8H,2H2,1H3 IEFDVDGOIVKGRZ-UHFFFAOYSA-N 148.114 false false SA SO2 SO3 TISOPA C/C(=C\[CH2])/CO InChI=1S/C5H9O/c1-3-5(2)4-6/h3,6H,1,4H2,2H3 CLGHLEUXPPGIBO-UHFFFAOYSA-N 85.1244 false false TISOPC OC/C=C(\C)/[CH2] InChI=1S/C5H9O/c1-5(2)3-4-6/h3,6H,1,4H2,2H3 UFFMNYXYYUVEEC-UHFFFAOYSA-N 85.1244 false false 4-Hydroxy-2-methyl-1-butene-3-ylradical, [(E)-4-Hydroxy-2-methyl-2-butenyl]radical, [(Z)-4-Hydroxy-2-methyl-2-butenyl]radical VGLYOX C=CC(=O)C=O InChI=1S/C4H4O2/c1-2-4(6)3-5/h2-3H,1H2 SDQVYUNYDAWYIK-UHFFFAOYSA-N 84.0734 false false 16979-06-9, 3-Butenal, 2-oxo-, 2-Oxo-3-butenal, 2-oxobut-3-enal, AKOS025296251