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[1,1'-biphenyl]-4-carbonitrile, 3-amino-2-benzoyl-5-methyl-
SpectraBase Compound ID 9akX3QQDd3t
InChI InChI=1S/C21H16N2O/c1-14-12-17(15-8-4-2-5-9-15)19(20(23)18(14)13-22)21(24)16-10-6-3-7-11-16/h2-12H,23H2,1H3
InChIKey IBGUAXZDZPYWCE-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C21H16N2O
Exact Mass 312.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYxkkyQTmyO
Name [1,1'-biphenyl]-4-carbonitrile, 3-amino-2-benzoyl-5-methyl-
Alternate Name(s) 3-Amino-2-benzoyl-5-methyl-[1,1'-biphenyl]-4-carbonitrile 3-Amino-2-benzoyl-5-methylbiphenyl-4-carbonitrile 2-Amino-3-benzoyl-6-methyl-4-phenylbenzonitrile 2-Azanyl-6-methyl-4-phenyl-3-(phenylcarbonyl)benzenecarbonitrile
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Formula C21H16N2O
InChI InChI=1S/C21H16N2O/c1-14-12-17(15-8-4-2-5-9-15)19(20(23)18(14)13-22)21(24)16-10-6-3-7-11-16/h2-12H,23H2,1H3
InChIKey IBGUAXZDZPYWCE-UHFFFAOYSA-N
Molecular Weight 312.372 g/mol
SMILES Nc1c(c(cc(C)c1C#N)-c1ccccc1)C(=O)c1ccccc1
SPLASH splash10-03di-3449000000-1f53d39870a5e0744b75
Source of Spectrum JX-2015-3-12
Wiley ID 1723614