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3-(benzylthio)-5-(p-tert-butylphneyl)-4H-1,2,4-triazole

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

3-(benzylthio)-5-(p-tert-butylphneyl)-4H-1,2,4-triazole
SpectraBase Compound ID KO6MxPaavFz
InChI InChI=1S/C19H21N3S/c1-19(2,3)16-11-9-15(10-12-16)17-20-18(22-21-17)23-13-14-7-5-4-6-8-14/h4-12H,13H2,1-3H3,(H,20,21,22)
InChIKey BLKIVCFOCBUTTJ-UHFFFAOYSA-N
Mol Weight 323.46 g/mol
Molecular Formula C19H21N3S
Exact Mass 323.145619 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 3eMxGqnsTAJ
Name 3-(BENZYLTHIO)-5-(p-tert-BUTYLPHENYL)-4H-1,2,4-TRIAZOLE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number SPB 575
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3S
InChI InChI=1S/C19H21N3S/c1-19(2,3)16-11-9-15(10-12-16)17-20-18(22-21-17)23-13-14-7-5-4-6-8-14/h4-12H,13H2,1-3H3,(H,20,21,22)
InChIKey BLKIVCFOCBUTTJ-UHFFFAOYSA-N
Melting Point 160-162C
Molecular Weight 323.458008
Synonyms TRIAZOLE, 4H-1,2,4-, 3-/BENZYL- THIO/-5-/P-TERT-BUTYLPHENYL/-,
Technique KBr WAFER