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8-Acetoxy-3-acetoxymethyl-2-bromo-1-hydroxyanthraquinone
SpectraBase Compound ID EyqaXHGnq2t
InChI InChI=1S/C19H13BrO7/c1-8(21)26-7-10-6-12-15(19(25)16(10)20)18(24)14-11(17(12)23)4-3-5-13(14)27-9(2)22/h3-6,25H,7H2,1-2H3
InChIKey YHOMJFSGJZBHNU-UHFFFAOYSA-N
Mol Weight 433.21 g/mol
Molecular Formula C19H13BrO7
Exact Mass 431.984466 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 78Kx8nvSr2V
Name 8-Acetoxy-3-acetoxymethyl-2-bromo-1-hydroxyanthraquinone
Alternate Name(s) [5-(acetyloxy)-3-bromo-4-hydroxy-9,10-dioxo-9,10-dihydro-2-anthracenyl]methyl acetate
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Formula C19H13BrO7
InChI InChI=1S/C19H13BrO7/c1-8(21)26-7-10-6-12-15(19(25)16(10)20)18(24)14-11(17(12)23)4-3-5-13(14)27-9(2)22/h3-6,25H,7H2,1-2H3
InChIKey YHOMJFSGJZBHNU-UHFFFAOYSA-N
Molecular Weight 433.210 g/mol
SMILES Oc1c(c(cc2C(=O)c3cccc(c3C(=O)c12)OC(=O)C)COC(=O)C)Br
SPLASH splash10-0006-9012000000-209c4aa9ef1580f4cc85
Source of Spectrum J-67-5606-29
Wiley ID 1570524