Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-, (1α,2β,5α)-

• Formula: C₁₀H₁₆O
• Molecular weight: 152.2334
• IUPAC Standard InChI: InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3 Copy

  
• IUPAC Standard InChIKey: MQPHVIPKLRXGDJ-UHFFFAOYSA-N Copy
• CAS Registry Number: 15358-88-0
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Species with the same structure:
  • Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-
  • Bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl-, (1α,2α,5α)-
• Stereoisomers:
  • [1S-(1α,2β,5α)]-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
  • Isopinocamphone
  • (E)-Pinanone
  • pinocamphone isomer (T)
  • S-pinocamphone
  • (Z)-Pinocamphone
  • cis-Pinocamphone
• Other names: 3-Pinanone, cis; Isocamphopinone; Isopinocamphon; Isopinocamphone; 2,6,6-Trimethylbicyclo[3.1.1]heptan-3-one, (1α,2β,5α)-; Pinocamphone, cis-; (1S,2S,5R)-2,6,6-Trimethylbicyclo[3.1.1]heptan-3-one-rel-; cis-Pinocamphone; cis-pinocamphone (isopinocamphone); (1α,2β,5α)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-one
• Information on this page:
  • Normal alkane RI, polar column, temperature ramp
  • References
  • Notes
• Other data available:
  • Gas Chromatography
• Options:
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Normal alkane RI, polar column, temperature ramp

Go To: Top, References, Notes

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

References

Go To: Top, Normal alkane RI, polar column, temperature ramp, Notes

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

Kurose, Okamura, et al., 2007
Kurose, K.; Okamura, D.; Yatagai, M., Composition of the essential oils from the leaves of nine Pinus species and the cones of three of Pinus species, Flavour Fragr. J., 2007, 22, 1, 10-20, https://doi.org/10.1002/ffj.1609 . [all data]

Gancel, Ollé, et al., 2002
Gancel, A.-L.; Ollé, D.; Ollitrault, P.; Luro, F.; Brillouet, J.-M., Leaf and peel volatile compounds of an interspecific citrus somatic hybrid [Citrus aurantifolia (Christm.) Swing. + Citrus paradisi Macfayden], Flavour Fragr. J., 2002, 17, 6, 416-424, https://doi.org/10.1002/ffj.1119 . [all data]

Notes

Go To: Top, Normal alkane RI, polar column, temperature ramp, References

• Symbols used in this document:
  

  Tend	Final temperature
  Tstart	Initial temperature

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