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(4'-chlorobiphenyl-4-yl)acetonitrile
SpectraBase Compound ID 5TjcT5F7ilk
InChI InChI=1S/C14H10ClN/c15-14-7-5-13(6-8-14)12-3-1-11(2-4-12)9-10-16/h1-8H,9H2
InChIKey TXISRGUIOOTMEE-UHFFFAOYSA-N
Mol Weight 227.69 g/mol
Molecular Formula C14H10ClN
Exact Mass 227.050177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJxOajm2i6F
Name (4'-chlorobiphenyl-4-yl)acetonitrile
Alternate Name(s) 2-(4'-chloro-[1,1'-biphenyl]-4-yl)acetonitrile 2-[4-(4-Chlorophenyl)phenyl]ethanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10ClN
InChI InChI=1S/C14H10ClN/c15-14-7-5-13(6-8-14)12-3-1-11(2-4-12)9-10-16/h1-8H,9H2
InChIKey TXISRGUIOOTMEE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol1007026
Molecular Weight 227.694 g/mol
SMILES c1cc(ccc1Cl)-c1ccc(cc1)CC#N
SPLASH splash10-004l-2790000000-f9d4a6f93b1ac8ab773d
Source of Spectrum A1-12-2702/SM21-8b
Wiley ID 1752224