trans-Geranic acid methyl ester

• Formula: C₁₁H₁₈O₂
• Molecular weight: 182.2594
• IUPAC Standard InChI: InChI=1S/C11H18O2/c1-9(2)6-5-7-10(3)8-11(12)13-4/h6,8H,5,7H2,1-4H3/b10-8+ Copy

  
• IUPAC Standard InChIKey: ACOBBFVLNKYODD-CSKARUKUSA-N Copy
• CAS Registry Number: 1189-09-9
• 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:
  • 2,6-Octadienoic acid, 3,7-dimethyl-, methyl ester
• Stereoisomers:
  • 2,6-Octadienoic acid, 3,7-dimethyl-, methyl ester, (Z)-
• Other names: 2,6-Octadienoic acid, 3,7-dimethyl-, methyl ester, (E)-; E-Methylgeranate; Geranic acid methyl ester; Methyl geranoate; Methyl trans-geranate; Methyl geranate; Methyl (2E)-3,7-dimethyl-2,6-octadienoate; (E)-Geranic acid methyl ester; Methyl 2,6-octadienoate, 3,7-dimethyl, (E)-; Methyl (E)-2,6-octadienoate, 3,7-dimethyl; Methyl E-geranate; Methyl (E)-geraniate; 2,6-Octadienoic acid, 3,7-dimethyl-, methyl ester, (2E)-; (E)-Methyl 3,7-dimethylocta-2,6-dienoate; methyl (E)-3,7-dimethylocta-2,6-dienoate
• Information on this page:
  • Van Den Dool and Kratz RI, non-polar column, temperature ramp
  • References
  • Notes
• Other data available:
  • Mass spectrum (electron ionization)
  • Gas Chromatography
• Options:
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Van Den Dool and Kratz RI, non-polar column, temperature ramp

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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

References

Go To: Top, Van Den Dool and Kratz RI, non-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.

Mondello, Zappia, et al., 2002
Mondello, L.; Zappia, G.; Cotroneo, A.; Bonaccorsi, I.; Chowdhury, J.U.; Yusuf, M.; Dugo, G., Studies on the essential oil-bearing plants of Bangladesh. Part VIII. Composition of some Ocimum oils O. basilicum L. var. purpurascens; O. sanctum L. green; O. sanctum L. purple; O. americanum L., citral type; O. americanum L., camphor type, Flavour Fragr. J., 2002, 17, 5, 335-340, https://doi.org/10.1002/ffj.1108 . [all data]

Verzera, la Rosa, et al., 2000
Verzera, A.; la Rosa, G.; Zappalà, M.; Cotroneo, A., Essential oil composition of different cultivars of bergamot grown in Sicily, Ital. J. Food Sci., 2000, 12, 4, 493-501. [all data]

Chung, Eiserich, et al., 1993
Chung, T.Y.; Eiserich, J.P.; Shibamoto, T., Volatile compounds isolated from edible Korean chamchwi (Aster scaber Thunb), J. Agric. Food Chem., 1993, 41, 10, 1693-1697, https://doi.org/10.1021/jf00034a033 . [all data]

Flath, Light, et al., 1990
Flath, R.A.; Light, D.M.; Jang, E.B.; Mon, T.R.; John, J.O., Headspace Examination of Volatile Emissions from Ripening Papaya (Carica papaya L., Solo Variety), J. Agric. Food Chem., 1990, 38, 4, 1060-1063, https://doi.org/10.1021/jf00094a032 . [all data]

Notes

Go To: Top, Van Den Dool and Kratz RI, non-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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