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3-(2-Bromo-benzylsulfanyl)-5-trifluoromethyl-[1,2,4]triazol-4-ylamine
SpectraBase Compound ID IXcEfljZx26
InChI InChI=1S/C10H8BrF3N4S/c11-7-4-2-1-3-6(7)5-19-9-17-16-8(18(9)15)10(12,13)14/h1-4H,5,15H2
InChIKey DALXFJNRSRUEAY-UHFFFAOYSA-N
Mol Weight 353.16 g/mol
Molecular Formula C10H8BrF3N4S
Exact Mass 351.960515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDt6gWwr6Ks
Name 3-(2-Bromo-benzylsulfanyl)-5-trifluoromethyl-[1,2,4]triazol-4-ylamine
Alternate Name(s) 3-[(2-bromobenzyl)sulfanyl]-5-(trifluoromethyl)-4H-1,2,4-triazol-4-amine 3-[(2-bromophenyl)methylsulfanyl]-5-(trifluoromethyl)-1,2,4-triazol-4-amine 3-[(2-bromophenyl)methylthio]-5-(trifluoromethyl)-1,2,4-triazol-4-amine [3-[(2-bromobenzyl)thio]-5-(trifluoromethyl)-1,2,4-triazol-4-yl]amine
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Formula C10H8BrF3N4S
InChI InChI=1S/C10H8BrF3N4S/c11-7-4-2-1-3-6(7)5-19-9-17-16-8(18(9)15)10(12,13)14/h1-4H,5,15H2
InChIKey DALXFJNRSRUEAY-UHFFFAOYSA-N
Molecular Weight 353.161 g/mol
SMILES N[n]1c(nnc1SCc1c(Br)cccc1)C(F)(F)F
SPLASH splash10-02gc-9210000000-49b528b782af6ee3c7b6
Wiley ID 1465486