trans-1,3-octadiene

• Formula: C₈H₁₄
• Molecular weight: 110.1968
• IUPAC Standard InChI: InChI=1S/C8H14/c1-3-5-7-8-6-4-2/h3,5,7H,1,4,6,8H2,2H3/b7-5+ Copy

  
• IUPAC Standard InChIKey: QTYUSOHYEPOHLV-FNORWQNLSA-N Copy
• CAS Registry Number: 39491-65-1
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Stereoisomers:
  • 1,3-Octadiene
  • 1,cis-3-octadiene
• Other names: 1,trans-3-octadiene; (E)-1,3-octadiene; 1,3-Octadiene, E; 1,3-Octadiene, trans
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• Information on this page:
  • Gas phase ion energetics data
  • Gas Chromatography
  • References
  • Notes
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Gas phase ion energetics data

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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 as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

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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Normal alkane RI, 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.

Masclet, Mouvier, et al., 1981
Masclet, P.; Mouvier, G.; Bocquet, J.F., Effets electroniques et effets steriques dus a la substitution alcoyle dans les dienes conjugues, J. Chim. Phys., 1981, 78, 99. [all data]

Soják, Král'ovicová, et al., 1984
Soják, L.; Král'ovicová, E.; Ostrovský, I.; Leclercq, P.A., Retention behaviour of conjegated and isolated n-alkadienes. Identification of n-nona- and n-decadiens by capillary gas chromatography using structure-retention correlations and mass spectrometry, J. Chromatogr., 1984, 292, 1, 241-261, https://doi.org/10.1016/S0021-9673(01)96207-7 . [all data]

Soják, Ostrovský, et al., 1980
Soják, L.; Ostrovský, I.; Leclercq, P.A.; Rijks, J.A., Identification of n-hepta- and n-octadienes by high-resolution gas chromatography using structure-retention correlations and mass spectrometry, J. Chromatogr., 1980, 191, 187-198, https://doi.org/10.1016/S0021-9673(00)86379-7 . [all data]

Welsch, Engewald, et al., 1978
Welsch, Th.; Engewald, W.; Berger, P., IX. Das gas-chromatographische Retentionsverhalten isomerer Octine and Octadiine, Chromatographia, 1978, 11, 1, 5-9, https://doi.org/10.1007/BF02262945 . [all data]

Döring, Estel, et al., 1974
Döring, C.-E.; Estel, D.; Geyer, R.; Wendt, W.-H., Kapillargaschromatographische Analyse geradkettiger C₈-Diene, Z. Chem., 1974, 14, 7, 292-293, https://doi.org/10.1002/zfch.19740140730 . [all data]

Horiuchi, Umano, et al., 1998
Horiuchi, M.; Umano, K.; Shibamoto, T., Analysis of volatile compounds formed from fish oil heated with cysteine and trimethylamine oxide, J. Agric. Food Chem., 1998, 46, 12, 5232-5237, https://doi.org/10.1021/jf980482m . [all data]

Notes

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