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2-Allyl-3,6-dihydro-4,5-dimethyl-2H-thiine-2-carboxylic acid, ethyl ester
SpectraBase Compound ID GfBul6MoMma
InChI InChI=1S/C13H20O2S/c1-5-7-13(12(14)15-6-2)8-10(3)11(4)9-16-13/h5H,1,6-9H2,2-4H3
InChIKey LGIQXVWRXIBTHV-UHFFFAOYSA-N
Mol Weight 240.36 g/mol
Molecular Formula C13H20O2S
Exact Mass 240.118401 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9YoOmgI1dqt
Name 2-Allyl-3,6-dihydro-4,5-dimethyl-2H-thiine-2-carboxylic acid, ethyl ester
Comments 50.3 MHZ SPECTRUM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H20O2S
InChI InChI=1S/C13H20O2S/c1-5-7-13(12(14)15-6-2)8-10(3)11(4)9-16-13/h5H,1,6-9H2,2-4H3
InChIKey LGIQXVWRXIBTHV-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference G.W. Kirby, M.P. Mahajan, M.S.Rahman, J. Chem. Soc. Perkin I 2033 (1991).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3