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3-Oxo-butanoic acid, (3-phenyl-propyl) ester

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3-Oxo-butanoic acid, (3-phenyl-propyl) ester
SpectraBase Compound ID EtlmHbtebrk
InChI InChI=1S/C13H16O3/c1-11(14)10-13(15)16-9-5-8-12-6-3-2-4-7-12/h2-4,6-7H,5,8-10H2,1H3
InChIKey XPOCLMJKMPFRAM-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DFoikjwGSVM
Name 3-Oxo-butanoic acid, (3-phenyl-propyl) ester
CAS Registry Number 113778-34-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-11(14)10-13(15)16-9-5-8-12-6-3-2-4-7-12/h2-4,6-7H,5,8-10H2,1H3
InChIKey XPOCLMJKMPFRAM-UHFFFAOYSA-N
Literature Reference D.A. Evans, K.T. Chapman, E.M. Carreira, J. Am. Chem. Soc. 110, 3560 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3