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Methyl 4-[1,5,7-methoxy-3-[4-(2-methyl[1,3]dioxolan-2-yl)-3-oxobutyl]-9,10-dioxo-9,10-dihydroanthraquinon-2-yl]-3-methoxy-2-butenoate

View entire compound with spectra: 1 MS (GC)

Methyl 4-[1,5,7-methoxy-3-[4-(2-methyl[1,3]dioxolan-2-yl)-3-oxobutyl]-9,10-dioxo-9,10-dihydroanthraquinon-2-yl]-3-methoxy-2-butenoate
SpectraBase Compound ID L8m8lcUOOc3
InChI InChI=1S/C31H34O11/c1-31(41-9-10-42-31)16-18(32)8-7-17-11-22-27(30(40-6)21(17)12-20(37-3)15-25(33)39-5)29(35)23-13-19(36-2)14-24(38-4)26(23)28(22)34/h11,13-15H,7-10,12,16H2,1-6H3/b20-15-
InChIKey SETTYAPKGZSWKX-HKWRFOASSA-N
Mol Weight 582.6 g/mol
Molecular Formula C31H34O11
Exact Mass 582.210112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IfKllxQOWIC
Name Methyl 4-[1,5,7-methoxy-3-[4-(2-methyl[1,3]dioxolan-2-yl)-3-oxobutyl]-9,10-dioxo-9,10-dihydroanthraquinon-2-yl]-3-methoxy-2-butenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H34O11
InChI InChI=1S/C31H34O11/c1-31(41-9-10-42-31)16-18(32)8-7-17-11-22-27(30(40-6)21(17)12-20(37-3)15-25(33)39-5)29(35)23-13-19(36-2)14-24(38-4)26(23)28(22)34/h11,13-15H,7-10,12,16H2,1-6H3/b20-15-
InChIKey SETTYAPKGZSWKX-HKWRFOASSA-N
Molecular Weight 582.602 g/mol
SMILES c12C(c3cc(OC)cc(c3C(c2cc(c(c1OC)C\C(=C\C(=O)OC)OC)CCC(CC1(OCCO1)C)=O)=O)OC)=O
SPLASH splash10-000i-9000000000-fe9de56be3c9ba4fb8b6
Source of Spectrum J-65-3222-10
Wiley ID 1532627