2-Propanone, 1-(3,5,5-trimethyl-2-cyclohexen-1-ylidene)-, (Z)-

• Formula: C₁₂H₁₈O
• Molecular weight: 178.2707
• IUPAC Standard InChI: InChI=1S/C12H18O/c1-9-5-11(6-10(2)13)8-12(3,4)7-9/h5-6H,7-8H2,1-4H3/b11-6+ Copy

  
• IUPAC Standard InChIKey: BPMFQXXZWSBLRP-IZZDOVSWSA-N Copy
• CAS Registry Number: 16695-73-1
• 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: (1Z)-1-(3,5,5-Trimethyl-2-cyclohexen-1-ylidene)-2-propanone; cis-2-Propanone, 1-(3,5,5-trimethyl-2-cyclohexen-1-ylidene)-
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• Information on this page:
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Mass spectrum (electron ionization)
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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.

Setkova, Risticevic, et al., 2007
Setkova, L.; Risticevic, S.; Pawliszyn, J., Rapid headspace solid-phase microextraction-gas chromatographic?time-of-flight mass spectrometric method for qualitative profiling of ice wine volatile fraction II: Classification of Canadian and Czech ice wines using statistical evaluation of the data, J. Chromatogr. A, 2007, 1147, 2, 224-240, https://doi.org/10.1016/j.chroma.2007.02.052 . [all data]

Notes

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