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1-PHENYL-4-(1'-PIPERIDINOMETHYL)-DELTA(2)-1,2,3,4-TETRAZOLINO-5-THIONE

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1-PHENYL-4-(1'-PIPERIDINOMETHYL)-DELTA(2)-1,2,3,4-TETRAZOLINO-5-THIONE
SpectraBase Compound ID Kx0B29BqJL8
InChI InChI=1S/C13H17N5S/c19-13-17(11-16-9-5-2-6-10-16)14-15-18(13)12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2
InChIKey BEWAABANUDXGLA-UHFFFAOYSA-N
Mol Weight 275.37 g/mol
Molecular Formula C13H17N5S
Exact Mass 275.120467 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FQcTrPvZqND
Name 1-Phenyl-4-piperidinomethyl-2-tetrazolin-5-thione
CAS Registry Number 16618-41-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17N5S
InChI InChI=1S/C13H17N5S/c19-13-17(11-16-9-5-2-6-10-16)14-15-18(13)12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2
InChIKey BEWAABANUDXGLA-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference J.R. Bartels-Keith, M.T. Burgess, J. Org. Chem. 42, 3725 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Dioxane