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Chelidonic acid

View entire compound with spectra: 1 NMR

Chelidonic acid
SpectraBase Compound ID IF7NxbSguKI
InChI InChI=1S/2C7H4O6.2Na/c2*8-3-1-4(6(9)10)13-5(2-3)7(11)12;;/h2*1-2H,(H,9,10)(H,11,12);;/q;;2*+1/p-2
InChIKey YCFSNJBGSGOSTF-UHFFFAOYSA-L
Mol Weight 412.16953856 g/mol
Molecular Formula C14H6Na2O12
Exact Mass 411.965464 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5KhNumNbqir
Name 4-OXO-4H-PYRAN-2,6-DICARBOXYLIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4O6
InChI InChI=1S/2C7H4O6.2Na/c2*8-3-1-4(6(9)10)13-5(2-3)7(11)12;;/h2*1-2H,(H,9,10)(H,11,12);;/q;;2*+1/p-2
InChIKey YCFSNJBGSGOSTF-UHFFFAOYSA-L
Melting Point 262C
Molecular Weight 184.11
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms CHELIDONIC ACID 4H-PYRAN-2,6-DICARBOXYLIC ACID, 4-OXO-,