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2-(3-acetyl-4-hydroxy-9,10-diketo-2-anthryl)acetic acid
SpectraBase Compound ID J9B0yyW0TMT
InChI InChI=1S/C18H12O6/c1-8(19)14-9(7-13(20)21)6-12-15(18(14)24)17(23)11-5-3-2-4-10(11)16(12)22/h2-6,24H,7H2,1H3,(H,20,21)
InChIKey DIDRFQPFOQBKOO-UHFFFAOYSA-N
Mol Weight 324.29 g/mol
Molecular Formula C18H12O6
Exact Mass 324.063388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fg38DCdfPl
Name 2-(3-acetyl-4-hydroxy-9,10-diketo-2-anthryl)acetic acid
Alternate Name(s) 2-(3-acetyl-4-hydroxy-9,10-dioxo-2-anthracenyl)acetic acid 2-(3-acetyl-4-hydroxy-9,10-dioxo-2-anthryl)acetic acid 2-(3-acetyl-4-hydroxy-9,10-dioxoanthracen-2-yl)acetic acid 2-[3-ethanoyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]ethanoic acid
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Formula C18H12O6
InChI InChI=1S/C18H12O6/c1-8(19)14-9(7-13(20)21)6-12-15(18(14)24)17(23)11-5-3-2-4-10(11)16(12)22/h2-6,24H,7H2,1H3,(H,20,21)
InChIKey DIDRFQPFOQBKOO-UHFFFAOYSA-N
Molecular Weight 324.288 g/mol
SMILES Oc1c2c(cc(CC(=O)O)c1C(=O)C)C(c1ccccc1C2=O)=O
SPLASH splash10-0159-0190000000-0bb4892bdd09f2cf6f40
Source of Spectrum U-1996-274-11
Wiley ID 768225