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4-Phenyl-3-oxo-butanoic acid, ethyl ester anion

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4-Phenyl-3-oxo-butanoic acid, ethyl ester anion
SpectraBase Compound ID COHi8EvwRCj
InChI InChI=1S/C12H14O3/c1-2-15-12(14)9-11(13)8-10-6-4-3-5-7-10/h3-7,9,13H,2,8H2,1H3/p-1/b11-9-
InChIKey IZRXINWGUJTXNF-LUAWRHEFSA-M
Mol Weight 205.23 g/mol
Molecular Formula C12H13O3
Exact Mass 205.086469 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3soWsyZMQoO
Name 4-Phenyl-3-oxo-butanoic acid, ethyl ester anion
Comments sodium salt
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H13O3
InChI InChI=1S/C12H14O3/c1-2-15-12(14)9-11(13)8-10-6-4-3-5-7-10/h3-7,9,13H,2,8H2,1H3/p-1/b11-9-
InChIKey IZRXINWGUJTXNF-LUAWRHEFSA-M
Instrument Name Varian CFT-20
Literature Reference J.B. Lambert, S.M. Wharry, J. Am. Chem. Soc. 104, 5857 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6