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METHYL-(+/-)-3-(1'-BROMOETHYL)-1,6,8-TRIMETHOXY-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-CARBOXYLATE
SpectraBase Compound ID 6c65jD0h7Eb
InChI InChI=1S/C21H19BrO7/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/h6-9H,1-5H3
InChIKey DOZJRXQVNXNMON-UHFFFAOYSA-N
Mol Weight 463.28 g/mol
Molecular Formula C21H19BrO7
Exact Mass 462.031416 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4GjOE0lFN8E
Name 3-(1-bromoethyl)-1,6,8-trimethoxy-9,10-dioxo-2-anthracenecarboxylic acid methyl ester
Alternate Name(s) 3-(1-bromoethyl)-9,10-diketo-1,6,8-trimethoxy-anthracene-2-carboxylic acid methyl ester Methyl 3-(1-bromoethyl)-1,6,8-trimethoxy-9,10-bis(oxidanylidene)anthracene-2-carboxylate Methyl 3-(1-bromoethyl)-1,6,8-trimethoxy-9,10-dioxo-anthracene-2-carboxylate
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Formula C21H19BrO7
InChI InChI=1S/C21H19BrO7/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/h6-9H,1-5H3
InChIKey DOZJRXQVNXNMON-UHFFFAOYSA-N
Molecular Weight 463.280 g/mol
SMILES c12C(c3c(cc(cc3C(c2cc(c(c1OC)C(=O)OC)C(Br)C)=O)OC)OC)=O
SPLASH splash10-001i-0009000000-94485c966b26614e9402
Source of Spectrum B-47-1363-0
Wiley ID 1390939