For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Hydroxy-2-(5-methoxy-3-methyl-2-oxo-3-pentenyl)-propanedioic acid, diethyl ester
SpectraBase Compound ID AYBXYIMSw1f
InChI InChI=1S/C14H22O7/c1-5-20-12(16)14(18,13(17)21-6-2)9-11(15)10(3)7-8-19-4/h7,18H,5-6,8-9H2,1-4H3/b10-7-
InChIKey MDFXDVSWFDMXBK-YFHOEESVSA-N
Mol Weight 302.32 g/mol
Molecular Formula C14H22O7
Exact Mass 302.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID I4dtxUOzSzE
Name 2-Hydroxy-2-(5-methoxy-3-methyl-2-oxo-3-pentenyl)-propanedioic acid, diethyl ester
Comments VARIAN FT-80A OR BRUKER AC-300 SPECTROMETER|SHIFTCORRECTION: + 1 PPM - REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H22O7
InChI InChI=1S/C14H22O7/c1-5-20-12(16)14(18,13(17)21-6-2)9-11(15)10(3)7-8-19-4/h7,18H,5-6,8-9H2,1-4H3/b10-7-
InChIKey MDFXDVSWFDMXBK-YFHOEESVSA-N
Instrument Name see comment
Literature Reference J. Barluenga, F. Aznar, M-P. Cabal, J. Chem. Soc. Perkin I 633 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Neat liquid