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2-(4-Methylphenyl)-2,3,4-triphenylbut-2-ene-1,4-dione
SpectraBase Compound ID 24ytjDiQ4Bk
InChI InChI=1S/C29H22O2/c1-21-17-19-25(20-18-21)29(31)27(23-13-7-3-8-14-23)26(22-11-5-2-6-12-22)28(30)24-15-9-4-10-16-24/h2-20H,1H3/b27-26-
InChIKey PMCDTFPTRJVFHB-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 2OOaxwvRXU
Name 2-(4-Methylphenyl)-2,3,4-triphenylbut-2-ene-1,4-dione
Alternate Name(s) (Z)-1-(4-methylphenyl)-2,3,4-triphenyl-2-butene-1,4-dione (Z)-1-(4-methylphenyl)-2,3,4-triphenylbut-2-ene-1,4-dione (Z)-1-(4-methylphenyl)-2,3,4-triphenyl-but-2-ene-1,4-dione (Z)-1,2,3-triphenyl-4-(p-tolyl)but-2-ene-1,4-dione Bis(2,4,6-trimethylphenyl) benzene-1,2-dicarboxylate
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Formula C29H22O2
InChI InChI=1S/C29H22O2/c1-21-17-19-25(20-18-21)29(31)27(23-13-7-3-8-14-23)26(22-11-5-2-6-12-22)28(30)24-15-9-4-10-16-24/h2-20H,1H3/b27-26-
InChIKey PMCDTFPTRJVFHB-RQZHXJHFSA-N
Molecular Weight 402.493 g/mol
SMILES C(\C(=C/(C(=O)c1ccccc1)c1ccccc1)c1ccccc1)(c1ccc(cc1)C)=O
SPLASH splash10-0693-5910000000-59bd95140094f5bfc29f
Source of Spectrum O1-46-1288-4
Wiley ID 1669403