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4-Amino-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol

View entire compound with spectra: 1 MS (GC)

4-Amino-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID EaIKpZwWHMP
InChI InChI=1S/C3H3F3N4S/c4-3(5,6)1-8-9-2(11)10(1)7/h7H2,(H,9,11)
InChIKey CTUZXHZTENNONS-UHFFFAOYSA-N
Mol Weight 184.14 g/mol
Molecular Formula C3H3F3N4S
Exact Mass 184.003052 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXJYNIiTH3U
Name 4-Amino-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H3F3N4S
InChI InChI=1S/C3H3F3N4S/c4-3(5,6)1-8-9-2(11)10(1)7/h7H2,(H,9,11)
InChIKey CTUZXHZTENNONS-UHFFFAOYSA-N
Molecular Weight 184.140 g/mol
SMILES N[n]1c(nnc1S)C(F)(F)F
SPLASH splash10-0930-9200000000-19172141de0c0deedb66
Synonyms 4-Amino-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione 4-Amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl hydrosulfide 4-Azanyl-3-(trifluoromethyl)-1H-1,2,4-triazole-5-thione
Wiley ID 1450693