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5-(N-Methyl-N-phenylaminomethyl)-4-(2-chlorophenyl)-1,2,4-triazol-3-thione
SpectraBase Compound ID 4ToIgAJfHqK
InChI InChI=1S/C16H15ClN4S/c1-20(12-7-3-2-4-8-12)11-15-18-19-16(22)21(15)14-10-6-5-9-13(14)17/h2-10H,11H2,1H3,(H,19,22)
InChIKey QFVIDJHFFHJDHL-UHFFFAOYSA-N
Mol Weight 330.84 g/mol
Molecular Formula C16H15ClN4S
Exact Mass 330.070595 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5euO6bRQpjk
Name 5-(N-Methyl-N-phenylaminomethyl)-4-(2-chlorophenyl)-1,2,4-triazol-3-thione
Alternate Name(s) 4-(2-Chlorophenyl)-5-[(methylanilino)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClN4S
InChI InChI=1S/C16H15ClN4S/c1-20(12-7-3-2-4-8-12)11-15-18-19-16(22)21(15)14-10-6-5-9-13(14)17/h2-10H,11H2,1H3,(H,19,22)
InChIKey QFVIDJHFFHJDHL-UHFFFAOYSA-N
Molecular Weight 330.837 g/mol
SMILES N1N=C(N(C1=S)c1c(Cl)cccc1)CN(c1ccccc1)C
SPLASH splash10-00di-1901000000-c18a44ff2ff9f51eb67f
Source of Spectrum F4-0-3846-4
Wiley ID 1621066