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4H-1,2,4-Triazole, 3-(4-bromo-2-fluorobenzylthio)-5-trifluoromethyl-4-methyl-
SpectraBase Compound ID GBsogMn862J
InChI InChI=1S/C11H8BrF4N3S/c1-19-9(11(14,15)16)17-18-10(19)20-5-6-2-3-7(12)4-8(6)13/h2-4H,5H2,1H3
InChIKey UNTQTUJQCPCFKR-UHFFFAOYSA-N
Mol Weight 370.16 g/mol
Molecular Formula C11H8BrF4N3S
Exact Mass 368.955844 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27WydSihqy
Name 4H-1,2,4-Triazole, 3-(4-bromo-2-fluorobenzylthio)-5-trifluoromethyl-4-methyl-
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Formula C11H8BrF4N3S
InChI InChI=1S/C11H8BrF4N3S/c1-19-9(11(14,15)16)17-18-10(19)20-5-6-2-3-7(12)4-8(6)13/h2-4H,5H2,1H3
InChIKey UNTQTUJQCPCFKR-UHFFFAOYSA-N
Molecular Weight 370.164 g/mol
SMILES c1([n](c(SCc2c(cc(cc2)Br)F)nn1)C)C(F)(F)F
SPLASH splash10-000i-2901000000-3edaa11da65c33087c75
Source of Spectrum AD-0-2532-0
Synonyms 3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole 3-[(4-bromo-2-fluoro-benzyl)thio]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole 3-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole 3-[(4-Bromo-2-fluorobenzyl)sulfanyl]-4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazole 3-[(4-bromo-2-fluorophenyl)methylthio]-4-methyl-5-(trifluoromethyl)-1,2,4-triazole
Wiley ID 1431410