For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JD5f1y3IZmi
Name 3-CHLORO-p-TOLUNITRILE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 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
Melting Point 45-48C
Molecular Weight 151.60
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms P-TOLUNITRILE, 3-CHLORO-, BENZONITRILE, 3-CHLORO-4-METHYL-,