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4-(2-Chlorobenzyl)-3-phenyl-1H-1,2,4-triazole-5-thione

View entire compound with spectra: 1 MS (GC)

4-(2-Chlorobenzyl)-3-phenyl-1H-1,2,4-triazole-5-thione
SpectraBase Compound ID 8IGIi9GHLnl
InChI InChI=1S/C15H12ClN3S/c16-13-9-5-4-8-12(13)10-19-14(17-18-15(19)20)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,20)
InChIKey YUKJVNYBTVUHOP-UHFFFAOYSA-N
Mol Weight 301.8 g/mol
Molecular Formula C15H12ClN3S
Exact Mass 301.044046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YgjKMDPV6d
Name 4-(2-Chlorobenzyl)-3-phenyl-1H-1,2,4-triazole-5-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClN3S
InChI InChI=1S/C15H12ClN3S/c16-13-9-5-4-8-12(13)10-19-14(17-18-15(19)20)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,20)
InChIKey YUKJVNYBTVUHOP-UHFFFAOYSA-N
Molecular Weight 301.795 g/mol
SMILES N1N=C(N(C1=S)Cc1c(Cl)cccc1)c1ccccc1
SPLASH splash10-014i-1390000000-74b530314ce2c1d992fb
Source of Spectrum KC-60-856-1
Synonyms 4-[(2-chlorophenyl)methyl]-3-phenyl-1H-1,2,4-triazole-5-thione
Wiley ID 1583176