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3-Fluoro-4-(trifluoromethyl)benzoyl chloride

View entire compound with spectra: 2 NMR, 4 FTIR, and 1 Raman

3-Fluoro-4-(trifluoromethyl)benzoyl chloride
SpectraBase Compound ID 7d8xV6tzF6N
InChI InChI=1S/C8H3ClF4O/c9-7(14)4-1-2-5(6(10)3-4)8(11,12)13/h1-3H
InChIKey DPDAEMNQJYDHRQ-UHFFFAOYSA-N
Mol Weight 226.56 g/mol
Molecular Formula C8H3ClF4O
Exact Mass 225.980855 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G3BsK3tVeyB
Name 3-Fluoro-4-(trifluoromethyl)benzoyl chloride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 455377
CAS Registry Number 216144-68-2
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H3ClF4O
InChI 1S/C8H3ClF4O/c9-7(14)4-1-2-5(6(10)3-4)8(11,12)13/h1-3H
InChIKey DPDAEMNQJYDHRQ-UHFFFAOYSA-N
Observed nucleus 13C
Purity 95%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_010038