John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=LZeMPeVvDTt SpectraBase Spectrum ID=E1x3KkQVOxc

(accessed ).
(2S,3R,4S)-1-Ethoxycarbonyl-2-methyl-4-vinyl-pyrrolidine-3-carboxylic acid, methyl ester
SpectraBase Compound ID LZeMPeVvDTt
InChI InChI=1S/C12H19NO4/c1-5-9-7-13(12(15)17-6-2)8(3)10(9)11(14)16-4/h5,8-10H,1,6-7H2,2-4H3
InChIKey XMMCQSLRIXCFRW-UHFFFAOYSA-N
Mol Weight 241.29 g/mol
Molecular Formula C12H19NO4
Exact Mass 241.131408 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E1x3KkQVOxc
Name (2S,3R,4S)-1-Ethoxycarbonyl-2-methyl-4-vinyl-pyrrolidine-3-carboxylic acid, methyl ester
Comments ADDITIONAL SIGNALS PRESENT DUE TO PSEUDOROTATION
Copyright Copyright © 2002-2021 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H19NO4
InChI InChI=1S/C12H19NO4/c1-5-9-7-13(12(15)17-6-2)8(3)10(9)11(14)16-4/h5,8-10H,1,6-7H2,2-4H3
InChIKey XMMCQSLRIXCFRW-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference J. Cooper, D.W. Knight, P.T. Gallagher, J. Chem. Soc. Perkin I 705 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3
SpectraBase Batch ID 6mAOHXqNfHW