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5-(p-tert-butylphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol

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

5-(p-tert-butylphenyl)-4-methyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 6npWC7Gzt3g
InChI InChI=1S/C13H17N3S/c1-13(2,3)10-7-5-9(6-8-10)11-14-15-12(17)16(11)4/h5-8H,1-4H3,(H,15,17)
InChIKey WBHKPLKLHZOBRB-UHFFFAOYSA-N
Mol Weight 247.36 g/mol
Molecular Formula C13H17N3S
Exact Mass 247.114319 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4UNr7dYnBuc
Name 5-(p-tert-BUTYLPHENYL)-4-METHYL-4H-1,2,4-TRIAZOLE-3-THIOL
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number SPB 243
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N3S
InChI InChI=1S/C13H17N3S/c1-13(2,3)10-7-5-9(6-8-10)11-14-15-12(17)16(11)4/h5-8H,1-4H3,(H,15,17)
InChIKey WBHKPLKLHZOBRB-UHFFFAOYSA-N
Melting Point 225-228C
Molecular Weight 247.360001
Synonyms TRIAZOLE-3-THIOL, 4H-1,2,4-, 5-/P-TERT-BUTYLPHENYL/-4-METHYL-,
Technique KBr WAFER