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2-Phenyl-3-(benzyl)-1,2,4-triazole-5-thione
SpectraBase Compound ID 2ypLxJQZxfR
InChI InChI=1S/C15H13N3S/c19-15-16-14(11-12-7-3-1-4-8-12)18(17-15)13-9-5-2-6-10-13/h1-10H,11H2,(H,17,19)
InChIKey OTFHNCAQJWOLAN-UHFFFAOYSA-N
Mol Weight 267.35 g/mol
Molecular Formula C15H13N3S
Exact Mass 267.083019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID sndTVAKj2p
Name 2-Phenyl-3-(benzyl)-1,2,4-triazole-5-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N3S
InChI InChI=1S/C15H13N3S/c19-15-16-14(11-12-7-3-1-4-8-12)18(17-15)13-9-5-2-6-10-13/h1-10H,11H2,(H,17,19)
InChIKey OTFHNCAQJWOLAN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.200890074
Molecular Weight 267.350 g/mol
SMILES N1C(N=C(N1c1ccccc1)Cc1ccccc1)=S
SPLASH splash10-014i-7090000000-26d04f0556bcf123b2a8
Source of Spectrum CJC-26-390-6
Synonyms 5-Benzyl-1-phenyl-1H-1,2,4-triazole-3(2H)-thione
Wiley ID 1772186