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(5-acetoxy-6-bromo-3-methoxy-7-methyl-9,10-dioxo-1-anthryl) acetate
SpectraBase Compound ID Gh9mzWuEaEn
InChI InChI=1S/C20H15BrO7/c1-8-5-12-16(20(17(8)21)28-10(3)23)19(25)13-6-11(26-4)7-14(27-9(2)22)15(13)18(12)24/h5-7H,1-4H3
InChIKey DGFDPMHTJPIJSG-UHFFFAOYSA-N
Mol Weight 447.24 g/mol
Molecular Formula C20H15BrO7
Exact Mass 446.000116 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B7dGIj1pRWq
Name (5-acetoxy-6-bromo-3-methoxy-7-methyl-9,10-dioxo-1-anthryl) acetate
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Formula C20H15BrO7
InChI InChI=1S/C20H15BrO7/c1-8-5-12-16(20(17(8)21)28-10(3)23)19(25)13-6-11(26-4)7-14(27-9(2)22)15(13)18(12)24/h5-7H,1-4H3
InChIKey DGFDPMHTJPIJSG-UHFFFAOYSA-N
Molecular Weight 447.237 g/mol
SMILES C(C)(=O)Oc1c(c(cc2C(c3c(cc(cc3C(c12)=O)OC)OC(=O)C)=O)C)Br
SPLASH splash10-00kf-9007200000-62651bec03aa40aea547
Source of Spectrum J-65-3221-6
Synonyms (5-acetyloxy-6-bromo-3-methoxy-7-methyl-9,10-dioxoanthracen-1-yl) acetate Acetic acid (5-acetoxy-6-bromo-9,10-diketo-3-methoxy-7-methyl-1-anthryl) ester Acetic acid (5-acetyloxy-6-bromo-3-methoxy-7-methyl-9,10-dioxo-1-anthracenyl) ester
Wiley ID 1532633