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5-(2-Chloro-benzylsulfanyl)-1H-[1,2,4]triazole

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5-(2-Chloro-benzylsulfanyl)-1H-[1,2,4]triazole
SpectraBase Compound ID DPwIaP1hGHe
InChI InChI=1S/C9H8ClN3S/c10-8-4-2-1-3-7(8)5-14-9-11-6-12-13-9/h1-4,6H,5H2,(H,11,12,13)
InChIKey VFVGHCLXBZSMAE-UHFFFAOYSA-N
Mol Weight 225.7 g/mol
Molecular Formula C9H8ClN3S
Exact Mass 225.012746 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mwuVl9GYNr
Name 5-[(2-chlorobenzyl)thio]-1H-1,2,4-triazole
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8ClN3S
InChI InChI=1S/C9H8ClN3S/c10-8-4-2-1-3-7(8)5-14-9-11-6-12-13-9/h1-4,6H,5H2,(H,11,12,13)
InChIKey VFVGHCLXBZSMAE-UHFFFAOYSA-N
Molecular Weight 225.697 g/mol
SMILES [nH]1ncnc1SCc1c(Cl)cccc1
SPLASH splash10-004l-9600000000-b8f43c9f60c23e59f923
Synonyms 5-[(2-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazole 5-[(2-chlorophenyl)methylthio]-1H-1,2,4-triazole
Wiley ID 1466027