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3-(4-Chloro-phenyl)-5-piperidino-1,4,2-dithiazolium cation

View entire compound with spectra: 1 NMR

3-(4-Chloro-phenyl)-5-piperidino-1,4,2-dithiazolium cation
SpectraBase Compound ID BYTSsCngdLJ
InChI InChI=1S/C13H14ClN2S2/c14-11-6-4-10(5-7-11)12-15-18-13(17-12)16-8-2-1-3-9-16/h4-7H,1-3,8-9H2/q+1
InChIKey JEKJUPLDMMAYCU-UHFFFAOYSA-N
Mol Weight 297.84 g/mol
Molecular Formula C13H14ClN2S2
Exact Mass 297.028694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FkLpIofzH8c
Name 3-(4-Chloro-phenyl)-5-piperidino-1,4,2-dithiazolium cation
Comments tetrafluoroborate
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H14ClN2S2
InChI InChI=1S/C13H14ClN2S2/c14-11-6-4-10(5-7-11)12-15-18-13(17-12)16-8-2-1-3-9-16/h4-7H,1-3,8-9H2/q+1
InChIKey JEKJUPLDMMAYCU-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference F.S. Chan, M.P. Sammes, R.L.Harlow, J. Chem. Soc. Perkin I 899 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3CN