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5-tert-butyl-4-methyl-4H-1,2,4-triazole-3-thiol

View entire compound with spectra: 1 NMR, and 1 FTIR

5-tert-butyl-4-methyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID I4m8i6yWa70
InChI InChI=1S/C7H13N3S/c1-7(2,3)5-8-9-6(11)10(5)4/h1-4H3,(H,9,11)
InChIKey YATMLIUVWDNANG-UHFFFAOYSA-N
Mol Weight 171.26 g/mol
Molecular Formula C7H13N3S
Exact Mass 171.083019 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 7CFMJQIwkS4
Name 5-tert-BUTYL-4-METHYL-4H-1,2,4-TRIAZOLE-3-THIOL
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number CD 7622
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13N3S
InChI InChI=1S/C7H13N3S/c1-7(2,3)5-8-9-6(11)10(5)4/h1-4H3,(H,9,11)
InChIKey YATMLIUVWDNANG-UHFFFAOYSA-N
Melting Point 163-165C
Molecular Weight 171.261993
Synonyms TRIAZOLE-3-THIOL, 4H-1,2,4-, 5-TERT-BUTYL-4-METHYL-,
Technique KBr WAFER