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N-(4-Bromo-phenyl)-2-(4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide

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

N-(4-Bromo-phenyl)-2-(4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide
SpectraBase Compound ID 6XHMj3dHQ0I
InChI InChI=1S/C10H9BrN4OS/c11-7-1-3-8(4-2-7)14-9(16)5-17-10-12-6-13-15-10/h1-4,6H,5H2,(H,14,16)(H,12,13,15)
InChIKey BXSUMOOBFDWLAI-UHFFFAOYSA-N
Mol Weight 313.17 g/mol
Molecular Formula C10H9BrN4OS
Exact Mass 311.968045 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E4TYb043LrS
Name acetamide, N-(4-bromophenyl)-2-(4H-1,2,4-triazol-3-ylthio)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.968045099 u
Formula C10H9BrN4OS
InChI InChI=1S/C10H9BrN4OS/c11-7-1-3-8(4-2-7)14-9(16)5-17-10-12-6-13-15-10/h1-4,6H,5H2,(H,14,16)(H,12,13,15)
InChIKey BXSUMOOBFDWLAI-UHFFFAOYSA-N
Molecular Weight 313.173 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13865
Solvent DMSO-d6
Source Vendor ID: NMR/10300559; Lab Info: LP; Lab Number: LP-37ps01