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5-CYANO-6-CYANOMETHYL-4-PHENYL-1,2,3,4-TETRAHYDRO-2-PYRIDONE
SpectraBase Compound ID HQ34OnCXT6i
InChI InChI=1S/C14H11N3O/c15-7-6-13-12(9-16)11(8-14(18)17-13)10-4-2-1-3-5-10/h1-5,11H,6,8H2,(H,17,18)
InChIKey BZOVOWAYQKUIJG-UHFFFAOYSA-N
Mol Weight 237.26 g/mol
Molecular Formula C14H11N3O
Exact Mass 237.090212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYthOhpfzXb
Name 6-(cyanomethyl)-2-keto-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile
Alternate Name(s) 6-(cyanomethyl)-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile 6-(cyanomethyl)-2-oxo-4-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11N3O
InChI InChI=1S/C14H11N3O/c15-7-6-13-12(9-16)11(8-14(18)17-13)10-4-2-1-3-5-10/h1-5,11H,6,8H2,(H,17,18)
InChIKey BZOVOWAYQKUIJG-UHFFFAOYSA-N
Molecular Weight 237.262 g/mol
SMILES N1C(CC(C(=C1CC#N)C#N)c1ccccc1)=O
SPLASH splash10-002r-7090000000-7cc8dbb716eb9323cd00
Source of Spectrum H1-36-5-11
Wiley ID 755134