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4-(Chloromethyl)benzoyl chloride

View entire compound with spectra: 5 NMR, 4 FTIR, and 1 Raman

4-(Chloromethyl)benzoyl chloride
SpectraBase Compound ID 4ZgePeUyfkk
InChI InChI=1S/C8H6Cl2O/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5H2
InChIKey RCOVTJVRTZGSBP-UHFFFAOYSA-N
Mol Weight 189.04 g/mol
Molecular Formula C8H6Cl2O
Exact Mass 187.97957 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7HgyDouEUou
Name 4-(Chloromethyl)benzoyl chloride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 270784
CAS Registry Number 876-08-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6Cl2O
InChI InChI=1S/C8H6Cl2O/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5H2
InChIKey RCOVTJVRTZGSBP-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms p-chloromethylbenzoyl chloride 4-(chloromethyl)benzoic acid chloride 4-(chloromethyl)-1-benzenecarbonyl chloride
Wiley ID SIAL_13CNMR_004910