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METHYL-(E)-3-HYDROXY-3-METHYL-5-PHENYL-4-PENTENOATE

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METHYL-(E)-3-HYDROXY-3-METHYL-5-PHENYL-4-PENTENOATE
SpectraBase Compound ID sng9VAEDer
InChI InChI=1S/C13H16O3/c1-13(15,10-12(14)16-2)9-8-11-6-4-3-5-7-11/h3-9,15H,10H2,1-2H3/b9-8+
InChIKey UJDNHDWGLBJYJS-CMDGGOBGSA-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 JMqr2AGzd7w
Name METHYL-(E)-3-HYDROXY-3-METHYL-5-PHENYL-4-PENTENOATE
Compound Number 3J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-13(15,10-12(14)16-2)9-8-11-6-4-3-5-7-11/h3-9,15H,10H2,1-2H3/b9-8+
InChIKey UJDNHDWGLBJYJS-CMDGGOBGSA-N
Literature Reference Author S.E.DENMARK,Y.FAN
Literature Reference Citation J.AM.CHEM.SOC.,124,4233(2002)
Literature Reference DOI 10.1021/ja025670e
Molecular Weight 220.268 g/mol
Sample ID 49839
Solvent CDCl3