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D-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid
SpectraBase Compound ID CjDAp5YGgQS
InChI InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5-,7+/m1/s1
InChIKey AAWZDTNXLSGCEK-WYWMIBKRSA-N
Mol Weight 192.17 g/mol
Molecular Formula C7H12O6
Exact Mass 192.063388 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J3SOMLoibI8
Name 1,3,4,5-TETRAHYDROXYCYCLOHEXANECARBOXYLIC ACID
Source of Sample C. J. Kelley, R. C. Harruff, M. Carmack J. Org. Chem. 41, 449(1976)
CAS Registry Number 36413-60-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O6
InChI InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5-,7+/m1/s1
InChIKey AAWZDTNXLSGCEK-WYWMIBKRSA-N
Molecular Weight 192.17
Solvent Deuterium oxide; Reference=Dioxane; Temperature=Ambient Spectrometer= Not Reported
Synonyms CYCLOHEXANECARBOXYLIC ACID, 1,3,4,5-TETRAHYDROXY-, QUINIC ACID