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2-(4-Methylphenyl)-1,3,4-triphenylbut-2-ene-1,4-dione

View entire compound with spectra: 1 MS (GC)

2-(4-Methylphenyl)-1,3,4-triphenylbut-2-ene-1,4-dione
SpectraBase Compound ID 684N7na7m3a
InChI InChI=1S/C29H22O2/c1-21-17-19-23(20-18-21)27(29(31)25-15-9-4-10-16-25)26(22-11-5-2-6-12-22)28(30)24-13-7-3-8-14-24/h2-20H,1H3/b27-26-
InChIKey AQKFVIFOFQKMSS-RQZHXJHFSA-N
Mol Weight 402.49 g/mol
Molecular Formula C29H22O2
Exact Mass 402.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQ5QbmaAV39
Name 2-(4-Methylphenyl)-1,3,4-triphenylbut-2-ene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H22O2
InChI InChI=1S/C29H22O2/c1-21-17-19-23(20-18-21)27(29(31)25-15-9-4-10-16-25)26(22-11-5-2-6-12-22)28(30)24-13-7-3-8-14-24/h2-20H,1H3/b27-26-
InChIKey AQKFVIFOFQKMSS-RQZHXJHFSA-N
Molecular Weight 402.493 g/mol
SMILES C(\C(=C/(C(=O)c1ccccc1)c1ccc(cc1)C)c1ccccc1)(=O)c1ccccc1
SPLASH splash10-0a4i-3920100000-ee9e2d31842377f8ef62
Source of Spectrum O1-46-1288-3
Wiley ID 1669404