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3-(p-tert-butylphenyl)-4-methyl-5-[(2-propynyl)thio]-4H-1,2,4-triazole

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

3-(p-tert-butylphenyl)-4-methyl-5-[(2-propynyl)thio]-4H-1,2,4-triazole
SpectraBase Compound ID J2kjoGTAflH
InChI InChI=1S/C16H19N3S/c1-6-11-20-15-18-17-14(19(15)5)12-7-9-13(10-8-12)16(2,3)4/h1,7-10H,11H2,2-5H3
InChIKey LUKAUOGWSZEEGC-UHFFFAOYSA-N
Mol Weight 285.41 g/mol
Molecular Formula C16H19N3S
Exact Mass 285.129969 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID K6ynSKVSBvL
Name 3-(p-tert-BUTYLPHENYL)-4-METHYL-5-[(2-PROPYNYL)THIO]-4H-1,2,4-TRIAZOLE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number SPB 247
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19N3S
InChI InChI=1S/C16H19N3S/c1-6-11-20-15-18-17-14(19(15)5)12-7-9-13(10-8-12)16(2,3)4/h1,7-10H,11H2,2-5H3
InChIKey LUKAUOGWSZEEGC-UHFFFAOYSA-N
Melting Point 117-120C
Molecular Weight 285.408997
Synonyms TRIAZOLE, 4H-1,2,4-, 3-/P-TERT-BUTYLPHENYL/-4-METHYL- 5-//2-PROPYNYL/THIO/-,
Technique KBr WAFER