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3-Chlorobenzyl cyanide
SpectraBase Compound ID TpbtCerXWp
InChI InChI=1S/C8H6ClN/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6H,4H2
InChIKey GTIKLPYCSAMPNG-UHFFFAOYSA-N
Mol Weight 151.6 g/mol
Molecular Formula C8H6ClN
Exact Mass 151.018877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1291DnVIF79
Name Benzeneacetonitrile, 3-chloro-
CAS Registry Number 1529-41-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6ClN
InChI InChI=1S/C8H6ClN/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6H,4H2
InChIKey GTIKLPYCSAMPNG-UHFFFAOYSA-N
Molecular Weight 151.596 g/mol
SMILES c1cc(cc(c1)Cl)CC#N
SPLASH splash10-0gb9-9800000000-c8586a6fd03c8cc771b8
Source of Spectrum W5-7292-0-0
Synonyms (3-Chlorophenyl)acetonitrile (m-Chlorophenyl)acetonitrile 2-(3-Chlorophenyl)acetonitrile 2-(3-Chlorophenyl)ethanenitrile 3-Chlorobenzeneacetonitrile 3-Chlorobenzyl cyanide Acetonitrile, (m-chlorophenyl)- m-Chlorobenzyl cyanide BRN 2042965 EINECS 216-213-9
Wiley ID 1148046