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5-Oxo-thiane-2,2-dicarboxylic acid, diethyl ester
SpectraBase Compound ID EGJHLJjYjJa
InChI InChI=1S/C11H16O5S/c1-3-15-9(13)11(10(14)16-4-2)6-5-8(12)7-17-11/h3-7H2,1-2H3
InChIKey PEOKUZLYAGKQCL-UHFFFAOYSA-N
Mol Weight 260.3 g/mol
Molecular Formula C11H16O5S
Exact Mass 260.071845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3AgWiHnOHqV
Name 5-Oxo-thiane-2,2-dicarboxylic acid, diethyl ester
Comments 50.3 MHZ SPECTRUM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H16O5S
InChI InChI=1S/C11H16O5S/c1-3-15-9(13)11(10(14)16-4-2)6-5-8(12)7-17-11/h3-7H2,1-2H3
InChIKey PEOKUZLYAGKQCL-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference G.W. Kirby, W.M. McGregor, J. Chem. Soc. Perkin I 3175 (1990).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3