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2-(Benzoyl)(cyano)methylene-1-methyltetrahydroimidazole
SpectraBase Compound ID D1a8wV4B1yk
InChI InChI=1S/C13H13N3O/c1-16-8-7-15-13(16)11(9-14)12(17)10-5-3-2-4-6-10/h2-6,15H,7-8H2,1H3/b13-11+
InChIKey ZSNHNNWLBXCSTO-ACCUITESSA-N
Mol Weight 227.27 g/mol
Molecular Formula C13H13N3O
Exact Mass 227.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HB03zK7npTt
Name 2-(Benzoyl)(cyano)methylene-1-methyltetrahydroimidazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N3O
InChI InChI=1S/C13H13N3O/c1-16-8-7-15-13(16)11(9-14)12(17)10-5-3-2-4-6-10/h2-6,15H,7-8H2,1H3/b13-11+
InChIKey ZSNHNNWLBXCSTO-ACCUITESSA-N
Molecular Weight 227.267 g/mol
SMILES N1CCN(\C1=C/(C(=O)c1ccccc1)C#N)C
SPLASH splash10-004i-2390000000-72f42f8921561e383466
Source of Spectrum SO-0-1275-5
Synonyms (2E)-2-(1-methyl-2-imidazolidinylidene)-3-oxo-3-phenylpropanenitrile
Wiley ID 1543793