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trans-1,4-Cyclohexanedicarboxylic acid

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trans-1,4-Cyclohexanedicarboxylic acid
SpectraBase Compound ID FCg8N4bcHLk
InChI InChI=1S/2C8H12O4.2Na/c2*9-7(10)5-1-2-6(4-3-5)8(11)12;;/h2*5-6H,1-4H2,(H,9,10)(H,11,12);;/q;;2*+1/p-2
InChIKey XOQBXYWMDQWIAP-UHFFFAOYSA-L
Mol Weight 388.32353856 g/mol
Molecular Formula C16H22Na2O8
Exact Mass 388.111006 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CUIUeGQhP2Q
Name trans-1,4-CYCLOHEXANEDICARBOXYLIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/2C8H12O4.2Na/c2*9-7(10)5-1-2-6(4-3-5)8(11)12;;/h2*5-6H,1-4H2,(H,9,10)(H,11,12);;/q;;2*+1/p-2
InChIKey XOQBXYWMDQWIAP-UHFFFAOYSA-L
Melting Point >300C
Molecular Weight 172.18
Solvent Deuterium oxide/NaOD; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms 1,4-CYCLOHEXANEDICARBOXYLIC ACID, trans-,