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3-Chlorobenzyl cyanide

View entire compound with spectra: 6 NMR, 5 FTIR, 1 Raman, and 1 MS (GC)

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

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KRUHTcwNgqq
Name (3-Chlorophenyl)acetonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number C27808
CAS Registry Number 1529-41-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 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
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3-Chlorobenzyl cyanide
Wiley ID SIAL_13CNMR_011103