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beta-BENZOYLHYDRATROPONITRILE
SpectraBase Compound ID AHb1pPFXV1v
InChI InChI=1S/C16H13NO/c17-12-15(13-7-3-1-4-8-13)11-16(18)14-9-5-2-6-10-14/h1-10,15H,11H2
InChIKey JRWUFQJVJGKCCT-UHFFFAOYSA-N
Mol Weight 235.29 g/mol
Molecular Formula C16H13NO
Exact Mass 235.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4OoPZzuVVI
Name 4-Oxo-2,4-diphenylbutanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NO
InChI InChI=1S/C16H13NO/c17-12-15(13-7-3-1-4-8-13)11-16(18)14-9-5-2-6-10-14/h1-10,15H,11H2
InChIKey JRWUFQJVJGKCCT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201600287
Molecular Weight 235.286 g/mol
SMILES C(C(CC(c1ccccc1)=O)c1ccccc1)#N
SPLASH splash10-0pdi-5910000000-f2052f5aa4c6cc544bb7
Source of Spectrum ASC-358-2134/SM11-3h
Wiley ID 1807441