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5-(4-Methoxy-phenyl)-3-(4-nitro-phenyl)-1,4,2-dithiazolium cation
SpectraBase Compound ID 5xprUJjFvW0
InChI InChI=1S/C15H11N2O3S2/c1-20-13-8-4-11(5-9-13)15-21-14(16-22-15)10-2-6-12(7-3-10)17(18)19/h2-9H,1H3
InChIKey SWEMXGJYSOAVNQ-UHFFFAOYSA-N
Mol Weight 332.39 g/mol
Molecular Formula C15H12N2O3S2
Exact Mass 332.028935 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DMmzrU6ZJP4
Name 5-(4-Methoxy-phenyl)-3-(4-nitro-phenyl)-1,4,2-dithiazolium cation
Comments PERCHLORATE, CF3CO2D AS SOLVENT
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Formula C15H12N2O3S2
InChI InChI=1S/C15H11N2O3S2/c1-20-13-8-4-11(5-9-13)15-21-14(16-22-15)10-2-6-12(7-3-10)17(18)19/h2-9H,1H3
InChIKey SWEMXGJYSOAVNQ-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