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(E)-2-(3,4,5-Trimethoxyphenyl)-4-(3,4-methylenedioxyphenyl)-4-oxo-2-butenoic acid
SpectraBase Compound ID CIsDL4mXC3j
InChI InChI=1S/C20H18O8/c1-24-17-7-12(8-18(25-2)19(17)26-3)13(20(22)23)9-14(21)11-4-5-15-16(6-11)28-10-27-15/h4-9H,10H2,1-3H3,(H,22,23)/b13-9+
InChIKey WBGMOLLTYLTJPZ-UKTHLTGXSA-N
Mol Weight 386.36 g/mol
Molecular Formula C20H18O8
Exact Mass 386.100168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EsMLQVAdQNu
Name (E)-2-(3,4,5-Trimethoxyphenyl)-4-(3,4-methylenedioxyphenyl)-4-oxo-2-butenoic acid
Alternate Name(s) (2E)-4-(1,3-benzodioxol-5-yl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-2-butenoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O8
InChI InChI=1S/C20H18O8/c1-24-17-7-12(8-18(25-2)19(17)26-3)13(20(22)23)9-14(21)11-4-5-15-16(6-11)28-10-27-15/h4-9H,10H2,1-3H3,(H,22,23)/b13-9+
InChIKey WBGMOLLTYLTJPZ-UKTHLTGXSA-N
Molecular Weight 386.356 g/mol
SMILES OC(\C(=C\C(c1cc2OCOc2cc1)=O)c1cc(OC)c(c(c1)OC)OC)=O
SPLASH splash10-004i-9202000000-63212f42265144abfe8a
Source of Spectrum F-50-9297-8
Wiley ID 1362542