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3-(4-Chloro-benzylsulfanyl)-5-furan-2-yl-4-methyl-4H-[1,2,4]triazole
SpectraBase Compound ID 8VNGOPKe5ud
InChI InChI=1S/C14H12ClN3OS/c1-18-13(12-3-2-8-19-12)16-17-14(18)20-9-10-4-6-11(15)7-5-10/h2-8H,9H2,1H3
InChIKey HVOIFSIXSRRUNQ-UHFFFAOYSA-N
Mol Weight 305.78 g/mol
Molecular Formula C14H12ClN3OS
Exact Mass 305.038961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rbajpgiKJV
Name 3-(4-Chloro-benzylsulfanyl)-5-furan-2-yl-4-methyl-4H-[1,2,4]triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12ClN3OS
InChI InChI=1S/C14H12ClN3OS/c1-18-13(12-3-2-8-19-12)16-17-14(18)20-9-10-4-6-11(15)7-5-10/h2-8H,9H2,1H3
InChIKey HVOIFSIXSRRUNQ-UHFFFAOYSA-N
Molecular Weight 305.783 g/mol
SMILES c1cc(Cl)ccc1CSc1[n](c(nn1)-c1occc1)C
SPLASH splash10-004i-7901000000-7b27c4330d4a794065aa
Synonyms 3-[(4-chlorobenzyl)sulfanyl]-5-(2-furyl)-4-methyl-4H-1,2,4-triazole 3-[(4-chlorobenzyl)thio]-5-(2-furyl)-4-methyl-1,2,4-triazole 3-[(4-chlorophenyl)methylsulfanyl]-5-(2-furyl)-4-methyl-1,2,4-triazole 3-[(4-chlorophenyl)methylsulfanyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole 3-[(4-chlorophenyl)methylthio]-5-(2-furanyl)-4-methyl-1,2,4-triazole 4-Chlorobenzyl 5-(2-furyl)-4-methyl-4H-1,2,4-triazol-3-yl sulfide
Wiley ID 1459886