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5-(3-Chlorophenyl)-4-(2,5-difluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID 7h04vX9JT3Q
InChI InChI=1S/C14H8ClF2N3S/c15-9-3-1-2-8(6-9)13-18-19-14(21)20(13)12-7-10(16)4-5-11(12)17/h1-7H,(H,19,21)
InChIKey POFNEUHKAQIWLB-UHFFFAOYSA-N
Mol Weight 323.75 g/mol
Molecular Formula C14H8ClF2N3S
Exact Mass 323.009552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HhRfl5j3rWv
Name 5-(3-Chlorophenyl)-4-(2,5-difluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Alternate Name(s) 4-[2,5-bis(fluoranyl)phenyl]-3-(3-chlorophenyl)-1H-1,2,4-triazole-5-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8ClF2N3S
InChI InChI=1S/C14H8ClF2N3S/c15-9-3-1-2-8(6-9)13-18-19-14(21)20(13)12-7-10(16)4-5-11(12)17/h1-7H,(H,19,21)
InChIKey POFNEUHKAQIWLB-UHFFFAOYSA-N
Molecular Weight 323.749 g/mol
SMILES N1N=C(N(C1=S)c1cc(F)ccc1F)c1cc(Cl)ccc1
SPLASH splash10-0fmi-1309000000-0116934e4dcd8a31920e
Source of Spectrum F2-46-246-21
Wiley ID 1689816