For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzoic acid, 2-(2,3-dibenzoyl-4-hydroxy-1,4-diphenyl-1,3-butadienyl)-, methyl ester, (Z,E)-
SpectraBase Compound ID 6dOB87g7bxK
InChI InChI=1S/C38H28O5/c1-43-38(42)31-25-15-14-24-30(31)32(26-16-6-2-7-17-26)33(35(39)27-18-8-3-9-19-27)34(36(40)28-20-10-4-11-21-28)37(41)29-22-12-5-13-23-29/h2-25,40H,1H3/b33-32-,36-34-
InChIKey JJQPFVVXCHXKBK-RLKPHMINSA-N
Mol Weight 564.6 g/mol
Molecular Formula C38H28O5
Exact Mass 564.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GZLd9dRxfui
Name Benzoic acid, 2-(2,3-dibenzoyl-4-hydroxy-1,4-diphenyl-1,3-butadienyl)-, methyl ester, (Z,E)-
Alternate Name(s) 1-Hydroxy-1,4-diphenyl-2,3-diphenylcarbonyl-4-(2-methoxycarbonylphenyl)-1,3-butadiene Methyl 2-[(1Z,3Z)-2,3-dibenzoyl-4-hydroxy-1,4-diphenyl-1,3-butadienyl]benzoate
CAS Registry Number 106976-66-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H28O5
InChI InChI=1S/C38H28O5/c1-43-38(42)31-25-15-14-24-30(31)32(26-16-6-2-7-17-26)33(35(39)27-18-8-3-9-19-27)34(36(40)28-20-10-4-11-21-28)37(41)29-22-12-5-13-23-29/h2-25,40H,1H3/b33-32-,36-34-
InChIKey JJQPFVVXCHXKBK-RLKPHMINSA-N
Molecular Weight 564.637 g/mol
SMILES O\C(=C\(\C(=C\(c1c(C(=O)OC)cccc1)c1ccccc1)C(=O)c1ccccc1)C(=O)c1ccccc1)c1ccccc1
SPLASH splash10-0a4i-0900020000-f8675626969bf2b305a4
Source of Spectrum J-52-1087-8
Wiley ID 1407193