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4-(2-Chlorobenzyl)benzonitrile
SpectraBase Compound ID BQN6XBkqsuB
InChI InChI=1S/C14H10ClN/c15-14-4-2-1-3-13(14)9-11-5-7-12(10-16)8-6-11/h1-8H,9H2
InChIKey MVGVISBBUPMVGK-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 C3nLe3mKntw
Name 4-(2-Chlorobenzyl)benzonitrile
Alternate Name(s) 4-[(2-Chlorophenyl)methyl]benzonitrile 4-[(2-Chlorophenyl)methyl]benzenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10ClN
InChI InChI=1S/C14H10ClN/c15-14-4-2-1-3-13(14)9-11-5-7-12(10-16)8-6-11/h1-8H,9H2
InChIKey MVGVISBBUPMVGK-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201109g
Molecular Weight 227.694 g/mol
SMILES c1c(Cl)c(ccc1)Cc1ccc(cc1)C#N
SPLASH splash10-0006-0940000000-0505b1d3a06d7af60184
Source of Spectrum A1-13-3198/SMS19-7f
Wiley ID 1753344