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5-Pyrimidinecarbonitrile, 1,2-dihydro-2-oxo-4-phenyl-

View entire compound with spectra: 1 MS (GC)

5-Pyrimidinecarbonitrile, 1,2-dihydro-2-oxo-4-phenyl-
SpectraBase Compound ID ae5cjSGXq7
InChI InChI=1S/C11H7N3O/c12-6-9-7-13-11(15)14-10(9)8-4-2-1-3-5-8/h1-5,7H,(H,13,14,15)
InChIKey ZYLPGVVYWVXSCO-UHFFFAOYSA-N
Mol Weight 197.2 g/mol
Molecular Formula C11H7N3O
Exact Mass 197.058912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7rD4iAdWUdb
Name 5-Pyrimidinecarbonitrile, 1,2-dihydro-2-oxo-4-phenyl-
Alternate Name(s) 2-keto-6-phenyl-1H-pyrimidine-5-carbonitrile 2-Oxidanylidene-6-phenyl-1H-pyrimidine-5-carbonitrile 2-Oxo-6-phenyl-1H-pyrimidine-5-carbonitrile
CAS Registry Number 89079-65-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7N3O
InChI InChI=1S/C11H7N3O/c12-6-9-7-13-11(15)14-10(9)8-4-2-1-3-5-8/h1-5,7H,(H,13,14,15)
InChIKey ZYLPGVVYWVXSCO-UHFFFAOYSA-N
Molecular Weight 197.197 g/mol
SMILES N1C=C(C(=NC1=O)c1ccccc1)C#N
SPLASH splash10-0002-0900000000-1d266f5412919d745d75
Source of Spectrum SB-37-615-0
Wiley ID 1194479