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Ellagic acid

View entire compound with spectra: 13 NMR, 2 FTIR, 1 Raman, and 1 MS (GC)

Ellagic acid
SpectraBase Compound ID HbJ9lXZ0pNN
InChI InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H
InChIKey AFSDNFLWKVMVRB-UHFFFAOYSA-N
Mol Weight 302.19 g/mol
Molecular Formula C14H6O8
Exact Mass 302.006267 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CXNaZ0R7ku1
Name ELLAGIC_ACID
Compound Number 2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H6O8
InChI InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H
InChIKey AFSDNFLWKVMVRB-UHFFFAOYSA-N
Literature Reference Author D.D.KHAC,S.TRAN-VAN,A.M.CAMPOS,J.Y.LALLEMAND,M.FETIZON
Literature Reference Citation PHYTOCHEM.,29,251(1990)
Literature Reference DOI 10.1016/0031-9422(90)89044-A
Molecular Weight 302.197 g/mol
Solvent Unknown
Source File Reference UWMZ25541