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Benzenepropanenitrile, .alpha.-[[4-(dimethylamino)phenyl]methylene]-.beta.-oxo-
SpectraBase Compound ID zQhUbjlgug
InChI InChI=1S/C18H16N2O/c1-20(2)17-10-8-14(9-11-17)12-16(13-19)18(21)15-6-4-3-5-7-15/h3-12H,1-2H3/b16-12-
InChIKey ZDFLQGAJFFWSSF-VBKFSLOCSA-N
Mol Weight 276.34 g/mol
Molecular Formula C18H16N2O
Exact Mass 276.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9LdVnKismu
Name Benzenepropanenitrile, .alpha.-[[4-(dimethylamino)phenyl]methylene]-.beta.-oxo-
Alternate Name(s) (Z)-2-benzoyl-3-(4-(dimethylamino)phenyl)acrylonitrile (Z)-2-benzoyl-3-[4-(dimethylamino)phenyl]-2-propenenitrile (Z)-2-benzoyl-3-[4-(dimethylamino)phenyl]prop-2-enenitrile (Z)-3-[4-(dimethylamino)phenyl]-2-(phenylcarbonyl)prop-2-enenitrile
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Formula C18H16N2O
InChI InChI=1S/C18H16N2O/c1-20(2)17-10-8-14(9-11-17)12-16(13-19)18(21)15-6-4-3-5-7-15/h3-12H,1-2H3/b16-12-
InChIKey ZDFLQGAJFFWSSF-VBKFSLOCSA-N
Molecular Weight 276.339 g/mol
SMILES CN(C)c1ccc(\C=C\(C#N)C(=O)c2ccccc2)cc1
SPLASH splash10-004i-4590000000-cd02e139d77416a9fb6f
Source of Spectrum JX-2015-2-741
Wiley ID 1722440