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

*Links on SpectraBase are not permalinks.
acetamide, N-(4-bromophenyl)-2-[[5-[[(4-chlorophenyl)amino]methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID IqnJ3jyrgaP
InChI InChI=1S/C24H21BrClN5OS/c1-16-4-2-3-5-21(16)31-22(14-27-19-12-8-18(26)9-13-19)29-30-24(31)33-15-23(32)28-20-10-6-17(25)7-11-20/h2-13,27H,14-15H2,1H3,(H,28,32)
InChIKey DSJNCDPIGPUISY-UHFFFAOYSA-N
Mol Weight 542.88 g/mol
Molecular Formula C24H21BrClN5OS
Exact Mass 541.033872 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H 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 9MizVDAci2y
Name acetamide, N-(4-bromophenyl)-2-[[5-[[(4-chlorophenyl)amino]methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 541.033872189 u
Formula C24H21BrClN5OS
InChI InChI=1S/C24H21BrClN5OS/c1-16-4-2-3-5-21(16)31-22(14-27-19-12-8-18(26)9-13-19)29-30-24(31)33-15-23(32)28-20-10-6-17(25)7-11-20/h2-13,27H,14-15H2,1H3,(H,28,32)
InChIKey DSJNCDPIGPUISY-UHFFFAOYSA-N
Molecular Weight 542.883 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16225
Solvent DMSO-d6
Source Vendor ID: NMR/10321187; Lab Info: DEM; Lab Number: DEM-0000335