Cyclohexanol

• Formula: C₆H₁₂O
• Molecular weight: 100.1589
• IUPAC Standard InChI: InChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2 Copy

  
• IUPAC Standard InChIKey: HPXRVTGHNJAIIH-UHFFFAOYSA-N Copy
• CAS Registry Number: 108-93-0
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Other names: Cyclohexyl alcohol; Adronal; Adronol; Anol; Hexahydrophenol; Hexalin; Hydroxycyclohexane; Naxol; Phenol, hexahydro-; 1-Cyclohexanol; Cyclohexane, hydroxy-; Hydralin; Cicloesanolo; Cykloheksanol; Hydrophenol; NSC 403656
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• Information on this page:
  • Gas phase ion energetics data
  • Mass spectrum (electron ionization)
  • References
  • Notes
• Other data available:
  • Gas phase thermochemistry data
  • Condensed phase thermochemistry data
  • Phase change data
  • Reaction thermochemistry data
  • Henry's Law data
  • IR Spectrum
  • Gas Chromatography
• Data at other public NIST sites:
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  • X-ray Photoelectron Spectroscopy Database, version 5.0
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Gas phase ion energetics data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

Ionization energy determinations

Appearance energy determinations

Mass spectrum (electron ionization)

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Additional Data

References

Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Rabbih and Selim, 1983
Rabbih, M.A.; Selim, E.T.M., A Mass spectrometric appearance energies study of cyclohexanol, Egypt. J. Phys., 1983, 14, 243. [all data]

Derrick, Holmes, et al., 1975
Derrick, P.J.; Holmes, J.L.; Morgan, R.P., Kinetics and mechanisms of the loss of water from the cyclohexanol radical ion at times from 50 picoseconds to 10 microseconds following field ionization, J. Am. Chem. Soc., 1975, 97, 4936. [all data]

Ward and Williams, 1969
Ward, R.S.; Williams, D.H., A study of water elimination as a function of ion lifetime in the mass spectrum of cyclohexanol, J. Organometal. Chem., 1969, 34, 3373. [all data]

Green, Bafus, et al., 1975
Green, M.M.; Bafus, D.; Franklin, J.L., Short communication; Combined deuterium labeling and appearance potential measurements to uncover competing reaction mechanisms in the electron- impact-induced loss of water from cyclohexanol, Org. Mass Spectrom., 1975, 10, 679. [all data]

Lewis and Hamill, 1970
Lewis, D.; Hamill, W.H., Excited states of neutral molecular fragments from appearance potentials by electron impact in a mass spectrometer, J. Chem. Phys., 1970, 52, 6348. [all data]

Green, 1980
Green, M.M., A stereochemical bridge between mass spectrometry and free radical chemistry, Tetrahedron, 1980, 36, 2687. [all data]

Notes

Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), References

• Symbols used in this document:
  

  AE	Appearance energy

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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