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2-(4-benzylidene-5-oxo-2-phenyl-4,5-dihydro-1H-imidazole-1-carbonyl)-3-(4-methoxyphenyl)acrylonitrile
SpectraBase Compound ID 3hHYUkwJDgH
InChI InChI=1S/C27H19N3O3/c1-33-23-14-12-20(13-15-23)16-22(18-28)26(31)30-25(21-10-6-3-7-11-21)29-24(27(30)32)17-19-8-4-2-5-9-19/h2-17H,1H3
InChIKey SWXHBCULTXNTEO-UHFFFAOYSA-N
Mol Weight 433.47 g/mol
Molecular Formula C27H19N3O3
Exact Mass 433.142641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HraER5OMLN
Name 2-(4-benzylidene-5-oxo-2-phenyl-4,5-dihydro-1H-imidazole-1-carbonyl)-3-(4-methoxyphenyl)acrylonitrile
Appearance Yellow crystals
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Formula C27H19N3O3
InChI InChI=1S/C27H19N3O3/c1-33-23-14-12-20(13-15-23)16-22(18-28)26(31)30-25(21-10-6-3-7-11-21)29-24(27(30)32)17-19-8-4-2-5-9-19/h2-17H,1H3
InChIKey SWXHBCULTXNTEO-UHFFFAOYSA-N
Instrument Name Shimadzu QP-2010 Plus
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3788
Molecular Weight 433.467 g/mol
SMILES c1(ccccc1)C=C1N=C(N(C1=O)C(=O)C(=Cc1ccc(cc1)OC)C#N)c1ccccc1
SPLASH splash10-0a4i-2901000000-cdade56516a7f834dccf
Source of Spectrum Y-57-385-6b
Wiley ID 1859808