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5-(prop-2-ynylthio)-1H-1,2,4-triazole

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5-(prop-2-ynylthio)-1H-1,2,4-triazole
SpectraBase Compound ID 7FiviPEcCG2
InChI InChI=1S/C5H5N3S/c1-2-3-9-5-6-4-7-8-5/h1,4H,3H2,(H,6,7,8)
InChIKey QFHGOLSDIGCZSJ-UHFFFAOYSA-N
Mol Weight 139.18 g/mol
Molecular Formula C5H5N3S
Exact Mass 139.020418 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FklNrNBN5Yb
Name 5-(PROP-2-YN-1-SULFANYL)-1H-1,2,4-TRIAZOLE;R1=H
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H5N3S
InChI InChI=1S/C5H5N3S/c1-2-3-9-5-6-4-7-8-5/h1,4H,3H2,(H,6,7,8)
InChIKey QFHGOLSDIGCZSJ-UHFFFAOYSA-N
Literature Reference Author U.D.PHALGUNE,K.VANKA,P.R.RAJAMOHANAN
Literature Reference Citation MAGN.RES.CHEM.,51,767(2013)
Literature Reference DOI 10.1002/mrc.4012
Solvent DMSO-D6
Source File Reference UWIR13266