Heptafluorobutyric acid, n-octadecyl ester

• Formula: C₂₂H₃₇F₇O₂
• Molecular weight: 466.5168
• IUPAC Standard InChI: InChI=1S/C22H37F7O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-31-19(30)20(23,24)21(25,26)22(27,28)29/h2-18H2,1H3 Copy

  
• IUPAC Standard InChIKey: ABJHYFXBHBSPMK-UHFFFAOYSA-N Copy
• CAS Registry Number: 400-57-7
• Chemical structure:
  This structure is also available as a 2d Mol file
• Other names: Octadecyl heptafluorobutyrate; Octadecyl 2,2,3,3,4,4,4-heptafluorobutanoate; 1-Octadecanol, heptafluorobutyrate; Octadecyl perfluorobutyrate; Octadecyl heptafluorobutanoate; Heptafluorobutyric acid, octadecyl ester
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• Information on this page:
  • Mass spectrum (electron ionization)
  • Gas Chromatography
  • References
  • Notes
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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

Gas Chromatography

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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

Kovats' RI, non-polar column, isothermal

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Kovats' RI, polar column, isothermal

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Van Den Dool and Kratz RI, non-polar column, temperature ramp

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Van Den Dool and Kratz RI, non-polar column, custom temperature program

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References

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

Zarazir, Chovin, et al., 1970
Zarazir, D.; Chovin, P.; Guiochon, G., Identification of hydroxylic compounds and their derivatives by gas chromatography, Chromatographia, 1970, 3, 4, 180-195, https://doi.org/10.1007/BF02269018 . [all data]

Zaikin, 2009
Zaikin, V.G., Personal Communication: Retention indices measured during the period 2008 to 2009, 2009. [all data]

Zheng and White, 2008
Zheng, Y.; White, E., Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2008. [all data]

Notes

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