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5-(2-Pyrazinyl)-1-methyl-4-hexyl-1,2,4-triazol-3-thiol

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5-(2-Pyrazinyl)-1-methyl-4-hexyl-1,2,4-triazol-3-thiol
SpectraBase Compound ID 6huBSMh9pOd
InChI InChI=1S/C13H19N5S/c1-3-4-5-6-9-18-12(17(2)16-13(18)19)11-10-14-7-8-15-11/h7-8,10H,3-6,9H2,1-2H3
InChIKey OENYTSJSWSHKMA-UHFFFAOYSA-N
Mol Weight 277.39 g/mol
Molecular Formula C13H19N5S
Exact Mass 277.136117 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jn9Z2d7SO1R
Name 5-(2-Pyrazinyl)-1-methyl-4-hexyl-1,2,4-triazol-3-thiol
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H19N5S
InChI InChI=1S/C13H19N5S/c1-3-4-5-6-9-18-12(17(2)16-13(18)19)11-10-14-7-8-15-11/h7-8,10H,3-6,9H2,1-2H3
InChIKey OENYTSJSWSHKMA-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference G.M. Shutske, M.N. Agnew, J. Heterocycl. Chem. 18, 1025 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6