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3-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole
SpectraBase Compound ID 6TRDyDoVBz
InChI InChI=1S/C13H12N4OS/c1-10-14-15-13(19-9-11-7-8-18-16-11)17(10)12-5-3-2-4-6-12/h2-8H,9H2,1H3
InChIKey FQIXOWLJKILVDO-UHFFFAOYSA-N
Mol Weight 272.33 g/mol
Molecular Formula C13H12N4OS
Exact Mass 272.073182 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CzWFNn0IsK
Name 3-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2-oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N4OS
InChI InChI=1S/C13H12N4OS/c1-10-14-15-13(19-9-11-7-8-18-16-11)17(10)12-5-3-2-4-6-12/h2-8H,9H2,1H3
InChIKey FQIXOWLJKILVDO-UHFFFAOYSA-N
Molecular Weight 272.326 g/mol
SMILES c1ccc(-[n]2c(nnc2C)SCc2nocc2)cc1
SPLASH splash10-0gdl-9520000000-70f39aa8de9479677221
Synonyms 3-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]isoxazole 3-[[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]isoxazole 4H-[1,2,4]Triazole, 3-(isoxazol-3-ylmethylsulfanyl)-5-methyl-4-phenyl-
Wiley ID 1439423