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1-Acetoxy-2-benzoyloxy-4-methoxyanthraquinone
SpectraBase Compound ID BiPNT4DDhTP
InChI InChI=1S/C24H16O7/c1-13(25)30-23-18(31-24(28)14-8-4-3-5-9-14)12-17(29-2)19-20(23)22(27)16-11-7-6-10-15(16)21(19)26/h3-12H,1-2H3
InChIKey VKJLVPXBIUVKRP-UHFFFAOYSA-N
Mol Weight 416.39 g/mol
Molecular Formula C24H16O7
Exact Mass 416.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Exmh06CjF9c
Name 1-Acetoxy-2-benzoyloxy-4-methoxyanthraquinone
Alternate Name(s) 1-(acetyloxy)-4-methoxy-9,10-dioxo-9,10-dihydro-2-anthracenyl benzoate benzoic acid (1-acetyloxy-4-methoxy-9,10-dioxo-2-anthracenyl) ester (1-acetyloxy-4-methoxy-9,10-dioxoanthracen-2-yl) benzoate (1-acetoxy-4-methoxy-9,10-dioxo-2-anthryl) benzoate [1-acetyloxy-4-methoxy-9,10-bis(oxidanylidene)anthracen-2-yl] benzoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H16O7
InChI InChI=1S/C24H16O7/c1-13(25)30-23-18(31-24(28)14-8-4-3-5-9-14)12-17(29-2)19-20(23)22(27)16-11-7-6-10-15(16)21(19)26/h3-12H,1-2H3
InChIKey VKJLVPXBIUVKRP-UHFFFAOYSA-N
Molecular Weight 416.385 g/mol
SMILES c1(c(cc(c2C(=O)c3ccccc3C(=O)c12)OC)OC(c1ccccc1)=O)OC(=O)C
SPLASH splash10-0a4i-0900000000-b860a73b8201e863e689
Source of Spectrum SO-0-439-3
Wiley ID 1542219