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p-Toluenethiol

View entire compound with spectra: 16 NMR, 5 FTIR, 1 UV-Vis, and 10 MS (GC)

p-Toluenethiol
SpectraBase Compound ID DgGcMwXN5X3
InChI InChI=1S/C7H8S/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3
InChIKey WLHCBQAPPJAULW-UHFFFAOYSA-N
Mol Weight 124.2 g/mol
Molecular Formula C7H8S
Exact Mass 124.034671 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IFqVqhDjXqG
Name 4-Methylbenzenethiol
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number T28525
CAS Registry Number 106-45-6
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8S
InChI InChI=1S/C7H8S/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3
InChIKey WLHCBQAPPJAULW-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms p-Thiocresol; 4-Mercaptotoluene; 4-Methylthiophenol; p-Toluenethiol; p-Tolyl mercaptan
Wiley ID SIAL_13CNMR_012807