Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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Cyclohexanecarboxylic Acid

Cyclohexanecarboxylic Acid synonyms


Graphical representations:


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Molecular Formula: C7H12O2

Natural Isotopic Abundance Mass: 128.16898

Mono-Isotopic Molecular Masses:

  • C12N14: 128.083729624
  • C13N14: 135.10721349
  • C12N15: 128.083729624
  • C13N15: 135.10721349

InChI string: InChI=1S/C7H12O2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,9)

IUPAC: Cyclohexanecarboxylic acid

PubChem Compound (CID): 7413

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73,