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Ethyl caffeate

View entire compound with spectra: 4 NMR, 2 FTIR, 1 Raman, and 2 MS (GC)

Ethyl caffeate
SpectraBase Compound ID 2nmkBMXZQV8
InChI InChI=1S/C11H12O4/c1-2-15-11(14)6-4-8-3-5-9(12)10(13)7-8/h3-7,12-13H,2H2,1H3/b6-4+
InChIKey WDKYDMULARNCIS-GQCTYLIASA-N
Mol Weight 208.21 g/mol
Molecular Formula C11H12O4
Exact Mass 208.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6hgxZpV0VJ1
Name ETHYL-CAFFEATE
Compound Number A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12O4
InChI InChI=1S/C11H12O4/c1-2-15-11(14)6-4-8-3-5-9(12)10(13)7-8/h3-7,12-13H,2H2,1H3/b6-4+
InChIKey WDKYDMULARNCIS-GQCTYLIASA-N
Literature Reference Author M.XIANG,H.SUI,J.HU,Y.YAN
Literature Reference Citation J.MED.PLANT.RES.,5,1685(2011)
Molecular Weight 208.214 g/mol
Solvent DMSO-D6
Source File Reference UWBT15095