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Caffeic acid

View entire compound with spectra: 25 NMR, 3 FTIR, 1 UV-Vis, and 9 MS (GC)

Caffeic acid
SpectraBase Compound ID EId8scFWYs0
InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+
InChIKey QAIPRVGONGVQAS-DUXPYHPUSA-N
Mol Weight 180.16 g/mol
Molecular Formula C9H8O4
Exact Mass 180.042259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fa0onzMzMyW
Name CAFFEIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8O4
InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+
InChIKey QAIPRVGONGVQAS-DUXPYHPUSA-N
Literature Reference Author J.SUN,X.M.HE,M.M.ZHAO,L.LI,C.B.LI,Y.DONG
Literature Reference Citation MOLECULES,19,13147(2014)
Literature Reference DOI 10.3390/molecules190913147
Molecular Weight 180.160 g/mol
Solvent DMSO-D6
Source File Reference UWIR15104