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3,5-Bis(4-methoxy-phenyl)-1,4,2-dithiazolium cation

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3,5-Bis(4-methoxy-phenyl)-1,4,2-dithiazolium cation
SpectraBase Compound ID GBhmZff9BTK
InChI InChI=1S/C16H14NO2S2/c1-18-13-7-3-11(4-8-13)15-17-21-16(20-15)12-5-9-14(19-2)10-6-12/h3-10H,1-2H3
InChIKey CFCOBNPQMOTCLG-UHFFFAOYSA-N
Mol Weight 317.42 g/mol
Molecular Formula C16H15NO2S2
Exact Mass 317.054421 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4C5r994zOxM
Name 3,5-Bis(4-methoxy-phenyl)-1,4,2-dithiazolium cation
Comments PERCHLORATE, CF3CO2D AS SOLVENT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H15NO2S2
InChI InChI=1S/C16H14NO2S2/c1-18-13-7-3-11(4-8-13)15-17-21-16(20-15)12-5-9-14(19-2)10-6-12/h3-10H,1-2H3
InChIKey CFCOBNPQMOTCLG-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference S. Xie, S. Fan, M.P. Sammes, J. Chem. Soc. Perkin I 2465 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany