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1,3,5-TRIHYDROXY-2-CARBOETHOXY-9,10-ANTHRAQUINONE
SpectraBase Compound ID 2s4qvkIMTXg
InChI InChI=1S/C17H12O7/c1-2-24-17(23)13-10(19)6-8-12(16(13)22)14(20)7-4-3-5-9(18)11(7)15(8)21/h3-6,18-19,22H,2H2,1H3
InChIKey IBVXNQIICDZWAZ-UHFFFAOYSA-N
Mol Weight 328.28 g/mol
Molecular Formula C17H12O7
Exact Mass 328.058303 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 76Gi3H3su9U
Name 1,3,5-trihydroxy-9,10-diketo-anthracene-2-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O7
InChI InChI=1S/C17H12O7/c1-2-24-17(23)13-10(19)6-8-12(16(13)22)14(20)7-4-3-5-9(18)11(7)15(8)21/h3-6,18-19,22H,2H2,1H3
InChIKey IBVXNQIICDZWAZ-UHFFFAOYSA-N
Molecular Weight 328.276 g/mol
SMILES Oc1c2C(c3c(c(c(c(c3)O)C(=O)OCC)O)C(c2ccc1)=O)=O
SPLASH splash10-001i-0293000000-70607a005b536161d111
Source of Spectrum X2-57-1315-2
Synonyms 1,3,5-trihydroxy-9,10-dioxo-2-anthracenecarboxylic acid ethyl ester Ethyl 1,3,5-trihydroxy-9,10-dioxo-anthracene-2-carboxylate Ethyl 1,3,5-tris(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-carboxylate
Wiley ID 1605683