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(2Z)-3-(4-ETHOXYCARBONYLPHENYL)-5-HYDROXY-2-PENTENAL
SpectraBase Compound ID 75KPq2O71VV
InChI InChI=1S/C14H16O4/c1-2-18-14(17)13-5-3-11(4-6-13)12(7-9-15)8-10-16/h3-7,9,16H,2,8,10H2,1H3/b12-7-
InChIKey JOBSQWTWYUIPIJ-GHXNOFRVSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Q4Gyw0lLBD
Name (2Z)-3-(4-ETHOXYCARBONYLPHENYL)-5-HYDROXY-2-PENTENAL
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-2-18-14(17)13-5-3-11(4-6-13)12(7-9-15)8-10-16/h3-7,9,16H,2,8,10H2,1H3/b12-7-
InChIKey JOBSQWTWYUIPIJ-GHXNOFRVSA-N
Literature Reference Author S.E.DENMARK,T.KOBAYASHI
Literature Reference Citation J.ORG.CHEM.,68,5153(2003)
Literature Reference DOI 10.1021/jo034064e
Molecular Weight 248.279 g/mol
Solvent CDCl3
Source File Reference UWSI22410