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2-Chloro-6-fluorobenzonitrile

View entire compound with spectra: 16 NMR, 5 FTIR, 1 Raman, 1 UV-Vis, and 1 MS (GC)

2-Chloro-6-fluorobenzonitrile
SpectraBase Compound ID BMr3k4ax2VW
InChI InChI=1S/C7H3ClFN/c8-6-2-1-3-7(9)5(6)4-10/h1-3H
InChIKey XPTAYRHLHAFUOS-UHFFFAOYSA-N
Mol Weight 155.56 g/mol
Molecular Formula C7H3ClFN
Exact Mass 154.993805 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1bGe4tUQdvo
Name 2-Chloro-6-fluorobenzonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 188182
CAS Registry Number 668-45-1
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3ClFN
InChI 1S/C7H3ClFN/c8-6-2-1-3-7(9)5(6)4-10/h1-3H
InChIKey XPTAYRHLHAFUOS-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2-Fluoro-6-chlorobenzonitrile 2-chloro-6-fluorobenzenecarbonitrile
Wiley ID SIAL_13CNMR_002471