For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 2 NMR, and 1 FTIR

3-(p-tert-butylphenyl)-4-(p-cumenyl)-5-[(p-nitrobenzyl)thio]-4H-1,2,4-triazole
SpectraBase Compound ID FBIqNuJMt8C
InChI InChI=1S/C28H30N4O2S/c1-19(2)21-10-16-24(17-11-21)31-26(22-8-12-23(13-9-22)28(3,4)5)29-30-27(31)35-18-20-6-14-25(15-7-20)32(33)34/h6-17,19H,18H2,1-5H3
InChIKey BLGNUZYPPJHQRT-UHFFFAOYSA-N
Mol Weight 486.63 g/mol
Molecular Formula C28H30N4O2S
Exact Mass 486.208947 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AZxeVbsxE4s
Name 3-(p-tert-BUTYLPHENYL)-4-(p-CUMENYL)-5-[(p-NITROBENZYL)THIO]-4H-1,2,4-TRIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30N4O2S
InChI InChI=1S/C28H30N4O2S/c1-19(2)21-10-16-24(17-11-21)31-26(22-8-12-23(13-9-22)28(3,4)5)29-30-27(31)35-18-20-6-14-25(15-7-20)32(33)34/h6-17,19H,18H2,1-5H3
InChIKey BLGNUZYPPJHQRT-UHFFFAOYSA-N
Melting Point 181-183C
Molecular Weight 486.64
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms TRIAZOLE, 4H-1,2,4-, 3-/P-tert-BUTYLPHENYL/-4-/P-CUMENYL/- 5-//P-NITROBENZYL/THIO/-,