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4-(2-Iodophenyl)-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID 8MeBhfzv84
InChI InChI=1S/C14H9ClIN3S/c15-10-5-3-4-9(8-10)13-17-18-14(20)19(13)12-7-2-1-6-11(12)16/h1-8H,(H,18,20)
InChIKey BKTHXPCFOIAMIO-UHFFFAOYSA-N
Mol Weight 413.66 g/mol
Molecular Formula C14H9ClIN3S
Exact Mass 412.925041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jysFhtDfzn
Name 4-(2-Iodophenyl)-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9ClIN3S
InChI InChI=1S/C14H9ClIN3S/c15-10-5-3-4-9(8-10)13-17-18-14(20)19(13)12-7-2-1-6-11(12)16/h1-8H,(H,18,20)
InChIKey BKTHXPCFOIAMIO-UHFFFAOYSA-N
Molecular Weight 413.664 g/mol
SMILES N1N=C(N(C1=S)c1c(I)cccc1)c1cc(Cl)ccc1
SPLASH splash10-000b-4940000000-2652b25f2a7027472559
Source of Spectrum F2-46-245-18
Synonyms 3-(3-Chlorophenyl)-4-(2-iodanylphenyl)-1H-1,2,4-triazole-5-thione
Wiley ID 1689817