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3-Chloro-p-tolunitrile

View entire compound with spectra: 5 NMR, 5 FTIR, and 1 Raman

3-Chloro-p-tolunitrile
SpectraBase Compound ID 1XSO6oOB5Ly
InChI InChI=1S/C8H6ClN/c1-6-2-3-7(5-10)4-8(6)9/h2-4H,1H3
InChIKey INEMHABDFCKBID-UHFFFAOYSA-N
Mol Weight 151.6 g/mol
Molecular Formula C8H6ClN
Exact Mass 151.018877 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LmhUlotPkvo
Name 3-Chloro-4-methylbenzonitrile
Source of Sample Aldrich
Catalog Number 149705
CAS Registry Number 21423-81-4
Classification Aromatic nitriles & cumulated double bonds
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6ClN
InChI InChI=1S/C8H6ClN/c1-6-2-3-7(5-10)4-8(6)9/h2-4H,1H3
InChIKey INEMHABDFCKBID-UHFFFAOYSA-N
Purity 97%
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3-Chloro-p-tolunitrile
Technique Melt
Wiley ID SIAL_FTIR_1_1503