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5-(3-Chlorophenyl)-4-(2,4-dimethylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

View entire compound with spectra: 1 MS (GC)

5-(3-Chlorophenyl)-4-(2,4-dimethylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID TL1RG30ln4
InChI InChI=1S/C16H14ClN3S/c1-10-6-7-14(11(2)8-10)20-15(18-19-16(20)21)12-4-3-5-13(17)9-12/h3-9H,1-2H3,(H,19,21)
InChIKey XWHUSDCTZYSMKM-UHFFFAOYSA-N
Mol Weight 315.82 g/mol
Molecular Formula C16H14ClN3S
Exact Mass 315.059696 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LtephpzhuRk
Name 5-(3-Chlorophenyl)-4-(2,4-dimethylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14ClN3S
InChI InChI=1S/C16H14ClN3S/c1-10-6-7-14(11(2)8-10)20-15(18-19-16(20)21)12-4-3-5-13(17)9-12/h3-9H,1-2H3,(H,19,21)
InChIKey XWHUSDCTZYSMKM-UHFFFAOYSA-N
Molecular Weight 315.822 g/mol
SMILES N1N=C(N(C1=S)c1c(cc(cc1)C)C)c1cc(Cl)ccc1
SPLASH splash10-00lr-3396000000-e530f8ea1f235e4fb685
Source of Spectrum F2-45-5204-8g
Wiley ID 1703817