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2-Anthracenecarboxylic acid, 9,10-dihydro-3-hydroxy-6,8-dimethoxy-1-methyl-9,10-dioxo-, ethyl ester
SpectraBase Compound ID 5vJz3XCFzh3
InChI InChI=1S/C20H18O7/c1-5-27-20(24)16-9(2)15-12(8-13(16)21)18(22)11-6-10(25-3)7-14(26-4)17(11)19(15)23/h6-8,21H,5H2,1-4H3
InChIKey VOCOABUBQITMJN-UHFFFAOYSA-N
Mol Weight 370.36 g/mol
Molecular Formula C20H18O7
Exact Mass 370.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dnJ9VdAbk2
Name 2-Anthracenecarboxylic acid, 9,10-dihydro-3-hydroxy-6,8-dimethoxy-1-methyl-9,10-dioxo-, ethyl ester
CAS Registry Number 80751-00-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O7
InChI InChI=1S/C20H18O7/c1-5-27-20(24)16-9(2)15-12(8-13(16)21)18(22)11-6-10(25-3)7-14(26-4)17(11)19(15)23/h6-8,21H,5H2,1-4H3
InChIKey VOCOABUBQITMJN-UHFFFAOYSA-N
Molecular Weight 370.357 g/mol
SMILES Oc1c(c(c2C(c3c(cc(cc3C(c2c1)=O)OC)OC)=O)C)C(=O)OCC
SPLASH splash10-0006-0009000000-892bc3513785abba72b7
Source of Spectrum B-34-2414-0
Synonyms ethyl 3-hydroxy-6,8-dimethoxy-1-methyl-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylate Ethyl-3-hydroxy-6,8-dimethoxy-1-methylanthraquinone-2-carboxylate
Wiley ID 1354203