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2-METHYL-4-ETHYL-5-(2'-PYRAZINYL)-1,2,4-TRIAZOLE-3-THIONE

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2-METHYL-4-ETHYL-5-(2'-PYRAZINYL)-1,2,4-TRIAZOLE-3-THIONE
SpectraBase Compound ID 9Iyf7jJk0dK
InChI InChI=1S/C13H11N5S/c1-17-13(19)18(10-5-3-2-4-6-10)12(16-17)11-9-14-7-8-15-11/h2-9H,1H3
InChIKey DFIMCZZIGSRVQO-UHFFFAOYSA-N
Mol Weight 269.33 g/mol
Molecular Formula C13H11N5S
Exact Mass 269.073517 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JaYHOn8MlT8
Name 2-METHYL-4-ETHYL-5-(2'-PYRAZINYL)-1,2,4-TRIAZOLE-3-THIONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H11N5S
InChI InChI=1S/C13H11N5S/c1-17-13(19)18(10-5-3-2-4-6-10)12(16-17)11-9-14-7-8-15-11/h2-9H,1H3
InChIKey DFIMCZZIGSRVQO-UHFFFAOYSA-N
Literature Reference Author G.M.SHUTSKE,M.N.AGNEW
Literature Reference Citation J.HETCYCL.CHEM.,18,1025(1981)
Literature Reference DOI 10.1002/jhet.5570180534
Molecular Weight 269.324 g/mol
Solvent DMSO-D6
Source File Reference UWED7483