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4-(1,2,4-Triazol-4-yliminomethyl)-3-(3-trifluormethylphenyl)-2,3-dihydrothiazol-2-thione
SpectraBase Compound ID LBzbv6nSqKi
InChI InChI=1S/C13H8F3N5S2/c14-13(15,16)9-2-1-3-10(4-9)21-11(6-23-12(21)22)5-19-20-7-17-18-8-20/h1-8H/b19-5+
InChIKey JWDFFQAIUVWSAN-PTXOJBNSSA-N
Mol Weight 355.36 g/mol
Molecular Formula C13H8F3N5S2
Exact Mass 355.017322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9THiiweA7t9
Name 4-(1,2,4-Triazol-4-yliminomethyl)-3-(3-trifluormethylphenyl)-2,3-dihydrothiazol-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8F3N5S2
InChI InChI=1S/C13H8F3N5S2/c14-13(15,16)9-2-1-3-10(4-9)21-11(6-23-12(21)22)5-19-20-7-17-18-8-20/h1-8H/b19-5+
InChIKey JWDFFQAIUVWSAN-PTXOJBNSSA-N
Literature Reference DOI 10.1002_1521-3897(200006)342_5_445
Molecular Weight 355.357 g/mol
SMILES C1(SC=C(N1c1cc(ccc1)C(F)(F)F)\C=N\[n]1cnnc1)=S
SPLASH splash10-052s-2498000000-19a369126b503820574f
Source of Spectrum JF-342-454-3h
Synonyms (E)-4-(((4H-1,2,4-triazol-4-yl)imino)methyl)-3-(3-(trifluoromethyl)phenyl)thiazole-2(3H)-thione
Wiley ID 1766995