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5-(Trifluoromethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID 8qV7rU0VB70
InChI InChI=1S/C3H2F3N3S/c4-3(5,6)1-7-2(10)9-8-1/h(H2,7,8,9,10)
InChIKey GNXURBGECTYCRJ-UHFFFAOYSA-N
Mol Weight 169.13 g/mol
Molecular Formula C3H2F3N3S
Exact Mass 168.992153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BzRACTKtHpZ
Name 5-(Trifluoromethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
CAS Registry Number 68744-64-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H2F3N3S
InChI InChI=1S/C3H2F3N3S/c4-3(5,6)1-7-2(10)9-8-1/h(H2,7,8,9,10)
InChIKey GNXURBGECTYCRJ-UHFFFAOYSA-N
Molecular Weight 169.125 g/mol
SMILES N1C(=S)NN=C1C(F)(F)F
SPLASH splash10-014j-9300000000-94dc5782fdc103840828
Synonyms 2-[1,2,4]-Triazoline-5-thione, 3-trifluoromethyl- 3H-1,2,4-Triazole-3-thione, 1,2-dihydro-5-(trifluoromethyl)- 5-(Trifluoromethyl)-1,2,4-triazolin-3(2H)-thione 5-(trifluoromethyl)-1,2-dihydro-1,2,4-triazole-3-thione 5-Trifluoromethyl-4H-1,2,4-triazole-3(2H)-thione
Wiley ID 1458519