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METHYL-3-ACETYL-1,6,8-TRIMETHOXY-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-CARBOXYLATE
SpectraBase Compound ID F9bU6tofSdE
InChI InChI=1S/C21H18O8/c1-9(22)11-8-13-16(20(28-4)17(11)21(25)29-5)19(24)15-12(18(13)23)6-10(26-2)7-14(15)27-3/h6-8H,1-5H3
InChIKey IDWSLQXAXHYUJI-UHFFFAOYSA-N
Mol Weight 398.37 g/mol
Molecular Formula C21H18O8
Exact Mass 398.100168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IVmmCNI4hw
Name 3-acetyl-1,6,8-trimethoxy-9,10-dioxo-2-anthracenecarboxylic acid methyl ester
Alternate Name(s) 3-acetyl-9,10-diketo-1,6,8-trimethoxy-anthracene-2-carboxylic acid methyl ester methyl 3-acetyl-1,6,8-trimethoxy-9,10-dioxo-anthracene-2-carboxylate methyl 3-ethanoyl-1,6,8-trimethoxy-9,10-bis(oxidanylidene)anthracene-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C21H18O8
InChI InChI=1S/C21H18O8/c1-9(22)11-8-13-16(20(28-4)17(11)21(25)29-5)19(24)15-12(18(13)23)6-10(26-2)7-14(15)27-3/h6-8H,1-5H3
InChIKey IDWSLQXAXHYUJI-UHFFFAOYSA-N
Molecular Weight 398.367 g/mol
SMILES c12C(c3c(cc(cc3C(c2cc(c(c1OC)C(=O)OC)C(=O)C)=O)OC)OC)=O
SPLASH splash10-0udi-0009000000-51881d654460b359f062
Source of Spectrum B-47-1363-0
Wiley ID 1368344