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4-oxo-4H-pyran-2,6-dicarboxylic acid
SpectraBase Compound ID JXSD8H7hDcv
InChI InChI=1S/C7H4O6/c8-3-1-4(6(9)10)13-5(2-3)7(11)12/h1-2H,(H,9,10)(H,11,12)
InChIKey PBAYDYUZOSNJGU-UHFFFAOYSA-N
Mol Weight 184.1 g/mol
Molecular Formula C7H4O6
Exact Mass 184.000788 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5aCLF5X1khZ
Name CHELIDONIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H4O6
InChI InChI=1S/C7H4O6/c8-3-1-4(6(9)10)13-5(2-3)7(11)12/h1-2H,(H,9,10)(H,11,12)
InChIKey PBAYDYUZOSNJGU-UHFFFAOYSA-N
Literature Reference Author T.W.SHEN,U.FISINGER,A.POULEV,W.EISENREICH,I.WERNER,E.PLEINER ,A.BACHER,M.H.ZENK
Literature Reference Citation PHYTOCHEM.,57,33(2001)
Literature Reference DOI 10.1016/S0031-9422(00)00496-9
Molecular Weight 184.105 g/mol
Solvent D2O
Source File Reference UWVN2097