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

*Links on SpectraBase are not permalinks.
2-Benzoyl-4-phenyl-1-(p-tolyl)but-2-ene-1,4-dione
SpectraBase Compound ID JVdb1MTdflN
InChI InChI=1S/C24H18O3/c1-17-12-14-20(15-13-17)24(27)21(23(26)19-10-6-3-7-11-19)16-22(25)18-8-4-2-5-9-18/h2-16H,1H3
InChIKey WDNUIRKHRYYKRG-UHFFFAOYSA-N
Mol Weight 354.41 g/mol
Molecular Formula C24H18O3
Exact Mass 354.125594 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 5W0ILFZ6CqI
Name 2-Benzoyl-4-phenyl-1-(p-tolyl)but-2-ene-1,4-dione
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18O3
InChI InChI=1S/C24H18O3/c1-17-12-14-20(15-13-17)24(27)21(23(26)19-10-6-3-7-11-19)16-22(25)18-8-4-2-5-9-18/h2-16H,1H3
InChIKey WDNUIRKHRYYKRG-UHFFFAOYSA-N
Instrument Name Simadzu GC-MS QP5050
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.13.176
Molecular Weight 354.405 g/mol
Reported Formula C24H18O3
SMILES c1(ccccc1)C(=O)C(C(=O)c1ccc(cc1)C)=CC(=O)c1ccccc1
SPLASH splash10-014i-0932000000-9a541f61d1275a8da7fb
Sample Comments mixture of E/Z (52:48)
Source of Spectrum BJO-13-SM4-4ad
Thin-Layer Chromatography Rf = 0.38 and 0.36 (hexane / EtOAc, 5 :1)
Wiley ID 1848231