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beta-benzoyl-p-chlorohydratroponitrile
SpectraBase Compound ID 3dEhdiRhhBR
InChI InChI=1S/C16H12ClNO/c17-15-8-6-12(7-9-15)14(11-18)10-16(19)13-4-2-1-3-5-13/h1-9,14H,10H2
InChIKey BSVVRHQKPNQOMT-UHFFFAOYSA-N
Mol Weight 269.73 g/mol
Molecular Formula C16H12ClNO
Exact Mass 269.060742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ujwXP1mK0
Name 2-(4-Chlorophenyl)-4-oxo-4-phenylbutanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClNO
InChI InChI=1S/C16H12ClNO/c17-15-8-6-12(7-9-15)14(11-18)10-16(19)13-4-2-1-3-5-13/h1-9,14H,10H2
InChIKey BSVVRHQKPNQOMT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201600287
Molecular Weight 269.731 g/mol
SMILES C(C(CC(c1ccccc1)=O)c1ccc(cc1)Cl)#N
SPLASH splash10-0bvi-5910000000-1f252ee79c46f6b5d633
Source of Spectrum ASC-358-2134/SM12-3i
Wiley ID 1807442