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3-(2-Methyl-3-furanyl)-4-phenyl-1H-1,2,4-triazole-5-thione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(2-Methyl-3-furanyl)-4-phenyl-1H-1,2,4-triazole-5-thione
SpectraBase Compound ID 5UoyxCLllT7
InChI InChI=1S/C13H11N3OS/c1-9-11(7-8-17-9)12-14-15-13(18)16(12)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,18)
InChIKey UGMHSMHHRNSVFZ-UHFFFAOYSA-N
Mol Weight 257.31 g/mol
Molecular Formula C13H11N3OS
Exact Mass 257.062283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IB8Ys4S1cPo
Name 3-(2-Methyl-3-furanyl)-4-phenyl-1H-1,2,4-triazole-5-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11N3OS
InChI InChI=1S/C13H11N3OS/c1-9-11(7-8-17-9)12-14-15-13(18)16(12)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,18)
InChIKey UGMHSMHHRNSVFZ-UHFFFAOYSA-N
Molecular Weight 257.311 g/mol
SMILES Sc1[n](c(-c2c(occ2)C)nn1)-c1ccccc1
SPLASH splash10-0a4i-6960000000-af08f53fc730b23a1483
Synonyms 3-(2-Methyl-3-furyl)-4-phenyl-1H-1,2,4-triazole-5-thione 3-(2-Methylfuran-3-yl)-4-phenyl-1H-1,2,4-triazole-5-thione 5-(2-Methyl-3-furyl)-4-phenyl-4H-1,2,4-triazole-3-thiol
Wiley ID 1451060