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4-butyl-1,1-diketo-2,6-di(phenyl)-1,2,6-thiadiazinane-3,5-quinone

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4-butyl-1,1-diketo-2,6-di(phenyl)-1,2,6-thiadiazinane-3,5-quinone
SpectraBase Compound ID ETUBQuFSqlf
InChI InChI=1S/C19H20N2O4S/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)26(24,25)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3
InChIKey LEXSJUZUKVGUMD-UHFFFAOYSA-N
Mol Weight 372.44 g/mol
Molecular Formula C19H20N2O4S
Exact Mass 372.114378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IYOcFO1Frwm
Name 4-Butyl-2,6-diphenyl-2,3,5,6-tetrahydro-4H-1,2,6-thiadiazin-3,5-dione 1,1-dioxide
CAS Registry Number 102127-64-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H20N2O4S
InChI InChI=1S/C19H20N2O4S/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)26(24,25)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3
InChIKey LEXSJUZUKVGUMD-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference P. Goya, C. Ochoa, I. Rozas, A. Alemany, Magn. Res. Chem. 24, 444 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6