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2-(Benzylamino)-6-oxo-4-phenyl-1,6-dihydro-5-pyrimidinecarbonitrile
SpectraBase Compound ID 5RpjDiHJHvX
InChI InChI=1S/C18H14N4O/c19-11-15-16(14-9-5-2-6-10-14)21-18(22-17(15)23)20-12-13-7-3-1-4-8-13/h1-10H,12H2,(H2,20,21,22,23)
InChIKey WWQPKLUPSNOHFE-UHFFFAOYSA-N
Mol Weight 302.34 g/mol
Molecular Formula C18H14N4O
Exact Mass 302.116761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36uBOnYLO92
Name 2-(Benzylamino)-6-oxo-4-phenyl-1,6-dihydro-5-pyrimidinecarbonitrile
CAS Registry Number 122379-65-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N4O
InChI InChI=1S/C18H14N4O/c19-11-15-16(14-9-5-2-6-10-14)21-18(22-17(15)23)20-12-13-7-3-1-4-8-13/h1-10H,12H2,(H2,20,21,22,23)
InChIKey WWQPKLUPSNOHFE-UHFFFAOYSA-N
Molecular Weight 302.337 g/mol
SMILES N1C(NCc2ccccc2)=NC(=C(C1=O)C#N)c1ccccc1
SPLASH splash10-0udi-9805000000-04bee21b401ad80c71bb
Source of Spectrum AD-0-2532-0
Synonyms 2-(benzylamino)-4-keto-6-phenyl-1H-pyrimidine-5-carbonitrile 2-(benzylamino)-4-oxo-6-phenyl-1H-pyrimidine-5-carbonitrile 4-Oxidanylidene-6-phenyl-2-[(phenylmethyl)amino]-1H-pyrimidine-5-carbonitrile 4-Oxo-6-phenyl-2-[(phenylmethyl)amino]-1H-pyrimidine-5-carbonitrile Pyrimidine-5-carbonitrile, 3,4-dihydro-2-benzylamino-4-oxo-6-phenyl-
Wiley ID 1419656