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4-Chlorobenzyl mercaptan

View entire compound with spectra: 6 NMR, 5 FTIR, and 1 UV-Vis

4-Chlorobenzyl mercaptan
SpectraBase Compound ID 72Y6zjGJ6h7
InChI InChI=1S/C7H7ClS/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2
InChIKey GKQXPTHQTXCXEV-UHFFFAOYSA-N
Mol Weight 158.65 g/mol
Molecular Formula C7H7ClS
Exact Mass 157.995699 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Hp7srK22yA9
Name 4-Chlorobenzenemethanethiol
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number C28707
CAS Registry Number 6258-66-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7ClS
InChI InChI=1S/C7H7ClS/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2
InChIKey GKQXPTHQTXCXEV-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 4-Chlorobenzyl mercaptan
Wiley ID SIAL_13CNMR_011104