Ethanone, 2,2,2-trifluoro-1-phenyl-

• Formula: C₈H₅F₃O
• Molecular weight: 174.1199
• IUPAC Standard InChI: InChI=1S/C8H5F3O/c9-8(10,11)7(12)6-4-2-1-3-5-6/h1-5H Copy

  
• IUPAC Standard InChIKey: KZJRKRQSDZGHEC-UHFFFAOYSA-N Copy
• CAS Registry Number: 434-45-7
• 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: Acetophenone, 2,2,2-trifluoro-; α,α,α-Trifluoroacetophenone; Phenyl trifluoromethyl ketone; Trifluoroacetophenone; Trifluoromethyl phenyl ketone; 1,1,1-Trifluoroacetophenone; 2,2,2-Trifluoro-1-phenylethanone; 2,2,2-Trifluoroacetophenone; ω,ω,ω-Trifluoroacetophenone; alpha,alpha,alpha-Trifluoroacetophenone; (Trifluoroacetyl)benzene; NSC 42752; Benzene, trifluoroacetyl
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• Information on this page:
  • IR Spectrum
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Phase change data
  • Gas phase ion energetics data
  • Mass spectrum (electron ionization)
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IR Spectrum

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Data compiled by: Coblentz Society, Inc.

• SOLUTION (10% CCl4 FOR 5000-1330, 10% CS2 FOR 1330-625 CM^-1); Not specified, most likely a prism, grating, or hybrid spectrometer.; DIGITIZED BY NIST FROM HARD COPY; 4 cm^-1 resolution

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

• gas

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

Normal alkane RI, non-polar column, temperature ramp

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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.

Zenkevich, Eliseenkov, et al., 2006
Zenkevich, I.G.; Eliseenkov, E.V.; Kasatochkin, A.N., Application of Retention Indices in GC-MS Identification of Halogenated Organic Compounds, Mass Spectromery (Rus.), 2006, 3, 2, 131-140. [all data]

Notes

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