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5-tert-Butyl-5-methyl-3-(4-nitro-phenyl)-5H-1,4,2-dithiazole
SpectraBase Compound ID L6sQkX0ObN4
InChI InChI=1S/C13H16N2O2S2/c1-12(2,3)13(4)18-11(14-19-13)9-5-7-10(8-6-9)15(16)17/h5-8H,1-4H3
InChIKey QEGJFCLGGJUGEL-UHFFFAOYSA-N
Mol Weight 296.4 g/mol
Molecular Formula C13H16N2O2S2
Exact Mass 296.06532 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JRYaRvQ0YJB
Name 5-tert-Butyl-5-methyl-3-(4-nitro-phenyl)-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 C13H16N2O2S2
InChI InChI=1S/C13H16N2O2S2/c1-12(2,3)13(4)18-11(14-19-13)9-5-7-10(8-6-9)15(16)17/h5-8H,1-4H3
InChIKey QEGJFCLGGJUGEL-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