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2-HYDROXYETHYL-5-OXO-5-PHENYLPENTANOATE
SpectraBase Compound ID JZAwCdXqgw2
InChI InChI=1S/C13H16O4/c14-9-10-17-13(16)8-4-7-12(15)11-5-2-1-3-6-11/h1-3,5-6,14H,4,7-10H2
InChIKey CNPDXTFQNRKCQQ-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3BQngYrim7H
Name 2-HYDROXYETHYL-5-OXO-5-PHENYLPENTANOATE
Compound Number 3AI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c14-9-10-17-13(16)8-4-7-12(15)11-5-2-1-3-6-11/h1-3,5-6,14H,4,7-10H2
InChIKey CNPDXTFQNRKCQQ-UHFFFAOYSA-N
Literature Reference Author M.YASUDA,K.CHIBA,N.OHIGASHI,Y.KATOH,A.BABA
Literature Reference Citation J.AM.CHEM.SOC.,125,7291(2003)
Literature Reference DOI 10.1021/ja028853+
Molecular Weight 236.268 g/mol
Sample ID 41240
Solvent CDCl3