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4-(4-Methyl-benzylideneamino)-5-(4-methylphenyl)-2H-1,2,4-triazole-3(4H)-thione

View entire compound with spectra: 1 MS (GC)

4-(4-Methyl-benzylideneamino)-5-(4-methylphenyl)-2H-1,2,4-triazole-3(4H)-thione
SpectraBase Compound ID In9WROrfS3a
InChI InChI=1S/C17H16N4S/c1-12-3-7-14(8-4-12)11-18-21-16(19-20-17(21)22)15-9-5-13(2)6-10-15/h3-11H,1-2H3,(H,20,22)/b18-11+
InChIKey JPVYOZLLRQKPTQ-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 HmSbbuuU83o
Name 4-(4-Methyl-benzylideneamino)-5-(4-methylphenyl)-2H-1,2,4-triazole-3(4H)-thione
Alternate Name(s) 3-(p-tolyl)-4-[(E)-p-tolylmethyleneamino]-1H-1,2,4-triazole-5-thione 3-(4-Methylphenyl)-4-[(E)-(4-methylphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N4S
InChI InChI=1S/C17H16N4S/c1-12-3-7-14(8-4-12)11-18-21-16(19-20-17(21)22)15-9-5-13(2)6-10-15/h3-11H,1-2H3,(H,20,22)/b18-11+
InChIKey JPVYOZLLRQKPTQ-WOJGMQOQSA-N
Molecular Weight 308.403 g/mol
SMILES N1N=C(N(C1=S)\N=C\c1ccc(cc1)C)c1ccc(cc1)C
SPLASH splash10-00kf-2901000000-7b6393eefd2480ecafa8
Source of Spectrum F-67-3078-4d
Wiley ID 1686392