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

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4-ETHYL-2-METHYL-5-(2'-PYRAZINYL)-1,2,4-TRIAZOLE-3-THIONE
SpectraBase Compound ID 9VPtH5zqgvR
InChI InChI=1S/C9H11N5S/c1-3-14-8(12-13(2)9(14)15)7-6-10-4-5-11-7/h4-6H,3H2,1-2H3
InChIKey GPWLNQKKOLBEIC-UHFFFAOYSA-N
Mol Weight 221.28 g/mol
Molecular Formula C9H11N5S
Exact Mass 221.073517 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID By5XCKh2fsM
Name 4-ETHYL-2-METHYL-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 C9H11N5S
InChI InChI=1S/C9H11N5S/c1-3-14-8(12-13(2)9(14)15)7-6-10-4-5-11-7/h4-6H,3H2,1-2H3
InChIKey GPWLNQKKOLBEIC-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 221.280 g/mol
Solvent DMSO-D6
Source File Reference UWED7482