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4-Methyl-4H-1,2,4-triazole-3-thiol

View entire compound with spectra: 2 NMR, 4 FTIR, 1 Raman, and 2 MS (GC)

4-Methyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID D3s33Jexy2X
InChI InChI=1S/C3H5N3S/c1-6-2-4-5-3(6)7/h2H,1H3,(H,5,7)
InChIKey AGWWTUWTOBEQFE-UHFFFAOYSA-N
Mol Weight 115.15 g/mol
Molecular Formula C3H5N3S
Exact Mass 115.020418 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LOzzfUCMWHg
Name 4-Methyl-4H-1,2,4-triazole-3-thiol
Source of Sample Aldrich
Catalog Number 258938
CAS Registry Number 24854-43-1
Classification 5-membered aromatic heterocycles
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H5N3S
InChI InChI=1S/C3H5N3S/c1-6-2-4-5-3(6)7/h2H,1H3,(H,5,7)
InChIKey AGWWTUWTOBEQFE-UHFFFAOYSA-N
Purity 97%
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3-Mercapto-4-methyl-4H-1,2,4-triazole
Technique Mull
Wiley ID SIAL_FTIR_1_5070