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2-(trifluoromethyl)-3-veratroyl-benzo[f]benzofuran-4,9-quinone
SpectraBase Compound ID G5jyHncqqA5
InChI InChI=1S/C22H13F3O6/c1-29-13-8-7-10(9-14(13)30-2)17(26)16-15-18(27)11-5-3-4-6-12(11)19(28)20(15)31-21(16)22(23,24)25/h3-9H,1-2H3
InChIKey OQUKXIHLWYORRF-UHFFFAOYSA-N
Mol Weight 430.34 g/mol
Molecular Formula C22H13F3O6
Exact Mass 430.066423 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9HfQofSLlBA
Name 2-(trifluoromethyl)-3-veratroyl-benzo[f]benzofuran-4,9-quinone
Alternate Name(s) 3-(3,4-dimethoxybenzoyl)-2-(trifluoromethyl)benzo[f]benzofuran-4,9-dione 3-(3,4-dimethoxybenzoyl)-2-(trifluoromethyl)benzo[f][1]benzofuran-4,9-dione 3-(3,4-dimethoxyphenyl)carbonyl-2-(trifluoromethyl)benzo[f][1]benzofuran-4,9-dione 3-[(3,4-dimethoxyphenyl)-oxomethyl]-2-(trifluoromethyl)benzo[f]benzofuran-4,9-dione
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Formula C22H13F3O6
InChI InChI=1S/C22H13F3O6/c1-29-13-8-7-10(9-14(13)30-2)17(26)16-15-18(27)11-5-3-4-6-12(11)19(28)20(15)31-21(16)22(23,24)25/h3-9H,1-2H3
InChIKey OQUKXIHLWYORRF-UHFFFAOYSA-N
Molecular Weight 430.335 g/mol
SMILES c12c(c(C(F)(F)F)oc2C(=O)c2c(C1=O)cccc2)C(c1cc(OC)c(cc1)OC)=O
SPLASH splash10-001i-4541900000-e9ad80aa79e126edd3bd
Wiley ID 1444982