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3-METHYL-5-(PROP-2-YNYLTHIO)-1H-1,2,4-TRIAZOLE
SpectraBase Compound ID IjX918Z3Am0
InChI InChI=1S/C6H7N3S/c1-3-4-10-6-7-5(2)8-9-6/h1H,4H2,2H3,(H,7,8,9)
InChIKey RQCXUAQPEWWPFG-UHFFFAOYSA-N
Mol Weight 153.2 g/mol
Molecular Formula C6H7N3S
Exact Mass 153.036068 g/mol
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum SK-29-4421-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3:CD3OD
  • 3-METHYL-5-(PROP-2-YN-1-SULFANYL)-1H-1,2,4-TRIAZOLE;R1=ME
  • 5-Methyl-3-(prop-2-ynylthio)-1H-1,2,4-triazole
Title Journal or Book Year
GIAO/DFT studies on 1,2,4-triazole-5-thiones and their propargyl derivatives Magnetic Resonance in Chemistry 2013
Structural elucidation of propargylated products of 3-substituted-1,2,4-triazole-5-thiols by NMR techniques Magnetic Resonance in Chemistry 2008

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