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4-(2-Methyl-benzylideneamino)-5-(2-methylphenyl)-2H-1,2,4-triazole-3(4H)-thione
SpectraBase Compound ID CrpGitEDFzG
InChI InChI=1S/C17H16N4S/c1-12-7-3-5-9-14(12)11-18-21-16(19-20-17(21)22)15-10-6-4-8-13(15)2/h3-11H,1-2H3,(H,20,22)/b18-11+
InChIKey LRBNCXDYZFFBTH-WOJGMQOQSA-N
Mol Weight 308.4 g/mol
Molecular Formula C17H16N4S
Exact Mass 308.109568 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdbJVMCsg9G
Name 4-(2-Methyl-benzylideneamino)-5-(2-methylphenyl)-2H-1,2,4-triazole-3(4H)-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N4S
InChI InChI=1S/C17H16N4S/c1-12-7-3-5-9-14(12)11-18-21-16(19-20-17(21)22)15-10-6-4-8-13(15)2/h3-11H,1-2H3,(H,20,22)/b18-11+
InChIKey LRBNCXDYZFFBTH-WOJGMQOQSA-N
Molecular Weight 308.403 g/mol
SMILES N1N=C(N(C1=S)\N=C\c1c(C)cccc1)c1c(C)cccc1
SPLASH splash10-0a4l-0900000000-ca133a32d95bf3d66271
Source of Spectrum F-67-3078-4c
Synonyms 3-(o-tolyl)-4-[(E)-o-tolylmethyleneamino]-1H-1,2,4-triazole-5-thione 3-(2-Methylphenyl)-4-[(E)-(2-methylphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione
Wiley ID 1686393