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4-(2-bromanyl-4-methyl-phenyl)-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione
SpectraBase Compound ID K3ksOLvX57A
InChI InChI=1S/C16H14BrN3S/c1-10-3-6-12(7-4-10)15-18-19-16(21)20(15)14-8-5-11(2)9-13(14)17/h3-9H,1-2H3,(H,19,21)
InChIKey RNLSMNHBDKLXIU-UHFFFAOYSA-N
Mol Weight 360.27 g/mol
Molecular Formula C16H14BrN3S
Exact Mass 359.009182 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3f4kl1P4t5N
Name 4-(2-bromanyl-4-methyl-phenyl)-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14BrN3S
InChI InChI=1S/C16H14BrN3S/c1-10-3-6-12(7-4-10)15-18-19-16(21)20(15)14-8-5-11(2)9-13(14)17/h3-9H,1-2H3,(H,19,21)
InChIKey RNLSMNHBDKLXIU-UHFFFAOYSA-N
Molecular Weight 360.273 g/mol
SMILES N1N=C(N(C1=S)c1c(cc(cc1)C)Br)c1ccc(cc1)C
SPLASH splash10-03e9-0696000000-8cb67965575e206b84c4
Source of Spectrum J-62-5769-3
Synonyms 4-(2-bromo-4-methyl-phenyl)-3-(p-tolyl)-1H-1,2,4-triazole-5-thione 4-(2-bromo-4-methylphenyl)-3-(4-methylphenyl)-1H-1,2,4-triazole-5-thione
Wiley ID 1347665