1,3,6-Octatriene, 3,7-dimethyl-, (Z)-

• Formula: C₁₀H₁₆
• Molecular weight: 136.2340
• IUPAC Standard InChI: InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7-8H,1,6H2,2-4H3/b10-8- Copy

  
• IUPAC Standard InChIKey: IHPKGUQCSIINRJ-NTMALXAHSA-N Copy
• CAS Registry Number: 3338-55-4
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
  The 3d structure may be viewed using Java or Javascript.
• Species with the same structure:
  • Octane, 2,6-dimethyl-, hexadehydro deriv.
• Stereoisomers:
  • β-Ocimene
  • trans-β-Ocimene
• Other names: β-cis-Ocimene; cis-β-Ocimene; cis-3,7-Dimethyl-1,3,6-octatriene; Ocimene, cis-β-; (Z)-Ocimene; cis-Ocimene; (3Z)-3,7-Dimethyl-1,3,6-octatriene; β-Ocimene, (Z)-; β-(Z)-Ocimene; (Z)-β-Ocimene; (Z)-3,7-Dimethyl-1,3,6-octatriene; 1,3,6-Octatriene, 3,7-dimethyl-, (3Z)-; (Z)-3,7-Dimethylocta-1,3,6-triene; ocimene-y; β-Ocymene, (Z)-; (Z)- β-Ocimene (cis-ocimene); p-cis-Ocimene
• Information on this page:
  • Kovats' RI, polar column, isothermal
  • References
  • Notes
• Other data available:
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • Gas Chromatography
• Options:
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Kovats' RI, polar column, isothermal

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, Kovats' RI, polar column, isothermal, Notes

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

Saeed, Redant, et al., 1979
Saeed, T.; Redant, G.; Sandra, P., Kovats Indices of Monoterpene Hydrocarbons on Glass Capillary Columns, J. Hi. Res. Chromatogr. Chromatogr. Comm., 1979, 2, 2, 75-76, https://doi.org/10.1002/jhrc.1240020208 . [all data]

Malingré and Maarse, 1974
Malingré, T.M.; Maarse, H., Composition of the essential oil of Mentha aquatica, Phytochemistry, 1974, 13, 8, 1531-1535, https://doi.org/10.1016/0031-9422(74)80322-5 . [all data]

Notes

Go To: Top, Kovats' RI, polar column, isothermal, References

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