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3-(4-Chloro-phenyl)-5,5-diphenyl-5H-1,4,2-dithiazole
SpectraBase Compound ID 4v8VKKDVMAZ
InChI InChI=1S/C20H14ClNS2/c21-18-13-11-15(12-14-18)19-22-24-20(23-19,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14H
InChIKey LNHCDEQINIMSMQ-UHFFFAOYSA-N
Mol Weight 367.91 g/mol
Molecular Formula C20H14ClNS2
Exact Mass 367.02562 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID wZRaWvISy3
Name 3-(4-Chloro-phenyl)-5,5-diphenyl-5H-1,4,2-dithiazole
Comments JEOL FX90Q OR GSX270 SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H14ClNS2
InChI InChI=1S/C20H14ClNS2/c21-18-13-11-15(12-14-18)19-22-24-20(23-19,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14H
InChIKey LNHCDEQINIMSMQ-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference K-F. Wai, M.P. Sammes, J. Chem. Soc. Perkin I 183 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3