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1,2,3-Benzenetricarboxylic acid

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1,2,3-Benzenetricarboxylic acid
SpectraBase Compound ID 7fdC4MFalH7
InChI InChI=1S/2C9H6O6.Na/c2*10-7(11)4-2-1-3-5(8(12)13)6(4)9(14)15;/h2*1-3H,(H,10,11)(H,12,13)(H,14,15);/q;;+1/p-1
InChIKey NQXSXMNBXKZMBD-UHFFFAOYSA-M
Mol Weight 442.26 g/mol
Molecular Formula C18H11NaO12
Exact Mass 442.01482 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID iKrj8J4NV7
Name 1,2,3-BENZENETRICARBOXYLIC ACID
Source of Sample Tokyo Kasei Koygo Company, Ltd., Tokyo, Japan
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6O6
InChI InChI=1S/2C9H6O6.Na/c2*10-7(11)4-2-1-3-5(8(12)13)6(4)9(14)15;/h2*1-3H,(H,10,11)(H,12,13)(H,14,15);/q;;+1/p-1
InChIKey NQXSXMNBXKZMBD-UHFFFAOYSA-M
Melting Point 197C
Molecular Weight 210.14
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms HEMIMELLITIC ACID