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1H-1,2,3-Triazole-4-carboxamide, 5-mercapto-N-phenyl-
SpectraBase Compound ID 5J2ZAcIa5DY
InChI InChI=1S/C9H8N4OS/c14-8(7-9(15)12-13-11-7)10-6-4-2-1-3-5-6/h1-5H,(H,10,14)(H2,11,12,13,15)
InChIKey WJEVTTVDSKXMNE-UHFFFAOYSA-N
Mol Weight 220.25 g/mol
Molecular Formula C9H8N4OS
Exact Mass 220.041882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FfdbAGA7Hhy
Name 1H-1,2,3-Triazole-4-carboxamide, 5-mercapto-N-phenyl-
CAS Registry Number 125416-61-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N4OS
InChI InChI=1S/C9H8N4OS/c14-8(7-9(15)12-13-11-7)10-6-4-2-1-3-5-6/h1-5H,(H,10,14)(H2,11,12,13,15)
InChIKey WJEVTTVDSKXMNE-UHFFFAOYSA-N
Molecular Weight 220.250 g/mol
SMILES [nH]1nnc(c1S)C(Nc1ccccc1)=O
SPLASH splash10-0006-9130000000-1b7d02cd65299b6f2396
Source of Spectrum F-45-7337-0
Synonyms 5-Mercapto-1,2,3-thiadiazole-4-N-phenylcarboxamide N-phenyl-5-sulfanyl-1H-1,2,3-triazole-4-carboxamide
Wiley ID 1219316