Biological Magnetic Resonance Data Bank

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

CXF; N-Cyclohexylformamide


Graphical representations:


View large 3D structure

Molecular Formula: C7H13NO

Natural Isotopic Abundance Mass: 127.18422

Mono-Isotopic Molecular Masses:

  • C12N14: 127.0997140446
  • C13N14: 134.1231979092
  • C12N15: 128.0967489378
  • C13N15: 135.1202328024

InChI string: InChI=1S/C7H13NO/c9-6-8-7-4-2-1-3-5-7/h6-7H,1-5H2,(H,8,9)

PubChem Compound (CID): 13017
CAS Registry number: 766-93-8
Sigma-Aldrich: 120685_ALDRICH
MMDB: 5797.14
KEGG Compound ID: C11519
MMCD: cq_08139
MDL: MFCD00003828
PDB Compound ID: CXF

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,