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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID T0a9mJ1mem
Name N-(4-Bromo-phenyl)-2-(4H-[1,2,4]triazol-3-ylsulfanyl)-acetamide
CAS Registry Number 24706-78-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
SMILES [nH]1cnnc1SCC(Nc1ccc(cc1)Br)=O
SPLASH splash10-00di-2900000000-ef87410b69df00a7134c
Synonyms N-(4-bromophenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide N-(4-bromophenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide N-(4-bromophenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide
Wiley ID 1459820