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5-Acetoxy-1-benzyloxy-2-methoxyanthraquinone
SpectraBase Compound ID 5UpGkuZ02wx
InChI InChI=1S/C24H18O6/c1-14(25)30-18-10-6-9-16-20(18)22(26)17-11-12-19(28-2)24(21(17)23(16)27)29-13-15-7-4-3-5-8-15/h3-12H,13H2,1-2H3
InChIKey BJGNPHQSNKVLEP-UHFFFAOYSA-N
Mol Weight 402.4 g/mol
Molecular Formula C24H18O6
Exact Mass 402.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBHwhMiyHhI
Name 5-Acetoxy-1-benzyloxy-2-methoxyanthraquinone
Alternate Name(s) 5-(benzyloxy)-6-methoxy-9,10-dioxo-9,10-dihydro-1-anthracenyl acetate
Comments Less than 3 mono-isotopic peaks
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Formula C24H18O6
InChI InChI=1S/C24H18O6/c1-14(25)30-18-10-6-9-16-20(18)22(26)17-11-12-19(28-2)24(21(17)23(16)27)29-13-15-7-4-3-5-8-15/h3-12H,13H2,1-2H3
InChIKey BJGNPHQSNKVLEP-UHFFFAOYSA-N
Molecular Weight 402.402 g/mol
SMILES c1(c(ccc2C(=O)c3c(cccc3C(=O)c12)OC(=O)C)OC)OCc1ccccc1
SPLASH splash10-0006-9000000000-6040336f2c6731f83248
Source of Spectrum KC-61-1558-0
Wiley ID 1627611