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alpha-Toluenesulfonyl chloride

View entire compound with spectra: 5 NMR, 5 FTIR, 1 Raman, and 3 MS (GC)

alpha-Toluenesulfonyl chloride
SpectraBase Compound ID 2aPCANXAl8k
InChI InChI=1S/C7H7ClO2S/c8-11(9,10)6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKey OAHKWDDSKCRNFE-UHFFFAOYSA-N
Mol Weight 190.64 g/mol
Molecular Formula C7H7ClO2S
Exact Mass 189.985528 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D2ennsvZiGL
Name Phenylmethanesulfonyl chloride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 159719
CAS Registry Number 1939-99-7
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7ClO2S
InChI InChI=1S/C7H7ClO2S/c8-11(9,10)6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKey OAHKWDDSKCRNFE-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-Toluenesulfonyl chloride
Wiley ID SIAL_1HNMR_001819