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(R)-2-(3-chlorophenyl)-4-oxo-4-phenylbutanenitrile
SpectraBase Compound ID E58gAHqKr2I
InChI InChI=1S/C16H12ClNO/c17-15-8-4-7-13(9-15)14(11-18)10-16(19)12-5-2-1-3-6-12/h1-9,14H,10H2/t14-/m0/s1
InChIKey XRLOMJLIOGRXDM-AWEZNQCLSA-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 8TCh274cWuL
Name (R)-2-(3-chlorophenyl)-4-oxo-4-phenylbutanenitrile
Alternate Name(s) (2R)-2-(3-chlorophenyl)-4-oxo-4-phenylbutanenitrile (2R)-2-(3-chlorophenyl)-4-oxo-4-phenyl-butanenitrile (2R)-2-(3-chlorophenyl)-4-oxidanylidene-4-phenyl-butanenitrile
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Formula C16H12ClNO
InChI InChI=1S/C16H12ClNO/c17-15-8-4-7-13(9-15)14(11-18)10-16(19)12-5-2-1-3-6-12/h1-9,14H,10H2/t14-/m0/s1
InChIKey XRLOMJLIOGRXDM-AWEZNQCLSA-N
Literature Reference DOI 10.1039/c4gc00386a
Molecular Weight 269.731 g/mol
SMILES [C@](CC(=O)c1ccccc1)(c1cccc(c1)Cl)(C#N)[H]
SPLASH splash10-0a6r-4900000000-e305a29e298f799f0a10
Source of Spectrum GCH-16-3454/SM3-2e
Wiley ID 1755380