1,3,6,10-Dodecatetraene, 3,7,11-trimethyl-, (Z,E)-
- Formula: C15H24
- Molecular weight: 204.3511
- IUPAC Standard InChIKey: CXENHBSYCFFKJS-OXYODPPFSA-N
- CAS Registry Number: 26560-14-5
- 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. - Stereoisomers:
- Other names: (Z,E)-α-Farnesene; (3Z,6E)-3,7,11-Trimethyl-1,3,6,10-dodecatetraene; α-(Z,E)-Farnesene; (3Z,6E)- α-Farnesene; cis,trans-α-Farnesene; (Z)-3, (E)-6-α-Farnesene; (Z,E)-3,7,11-Trimethyl-1,3,6,10-dodecatetraene,; (Z)-α-Farnesene; ( Z, E)-farnesene; (Z,E)-α-Farnesen(3,7,11-Trimethyl-1,3,6,10-dodecatetraen); 1,3,6,10-Dodetetraene, 3,7,11-trimethyl-,[Z,E]
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Van Den Dool and Kratz RI, non-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
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | BP-1 | BP-1 | HP-5 | RTX-1 | DB-5 |
Column length (m) | 50. | 50. | 30. | 60. | 30. |
Carrier gas | He | He | N2 | He | He |
Substrate | |||||
Column diameter (mm) | 0.22 | 0.22 | 0.25 | 0.22 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 60. | 60. | 50. | 60. | 60. |
Tend (C) | 220. | 220. | 220. | 230. | 260. |
Heat rate (K/min) | 2. | 2. | 5. | 2. | 5. |
Initial hold (min) | 10. | ||||
Final hold (min) | 20. | 20. | 35. | ||
I | 1486. | 1477. | 1491. | 1482. | 1484. |
Reference | Boti, Koukoua, et al., 2007 | Duquesnoy, Castola, et al., 2007 | Flamini, Tebano, et al., 2007 | Paolini, Muselli, et al., 2007 | Sabulal, Dan, et al., 2007 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | SPB-1 | DB-5 | HP-5MS | HP-5 | HP-5MS |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.2 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 50. | 50. | 60. | 40. | 80. |
Tend (C) | 250. | 250. | 280. | 300. | 300. |
Heat rate (K/min) | 5. | 5. | 4. | 4. | 4. |
Initial hold (min) | 3. | 3. | 5. | 5. | |
Final hold (min) | 15. | 15. | |||
I | 1470. | 1462. | 1486. | 1491. | 1495.9 |
Reference | Blagojevic, Radulovic, et al., 2006 | Blagojevic, Radulovic, et al., 2006 | Saroglou, Dorizas, et al., 2006 | Vundac, Pfeifhofer, et al., 2006 | Zhao C.X., Li, et al., 2006 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | CP Sil 5 CB | HP-5 | DB-5MS | HP-5 | DB-5MS |
Column length (m) | 25. | 30. | 60. | 30. | 30. |
Carrier gas | He | N2 | He | N2 | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.4 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 80. | 60. | 40. | 60. | 40. |
Tend (C) | 270. | 220. | 200. | 220. | 200. |
Heat rate (K/min) | 10. | 5. | 2. | 5. | 4. |
Initial hold (min) | 10. | 10. | 5. | ||
Final hold (min) | 20. | 20. | |||
I | 1477. | 1491. | 1494. | 1491. | 1489. |
Reference | Ziegenbein, Hanssen, et al., 2006 | Flamini, Luigi Cioni, et al., 2005 | Seo and Baek, 2005 | Flamini, Luigi Cioni, et al., 2004 | Zheng, Kim, et al., 2004 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary |
---|---|---|---|
Active phase | HP-5 | HP-5 | HP-5 |
Column length (m) | 30. | 30. | 30. |
Carrier gas | N2 | N2 | He |
Substrate | |||
Column diameter (mm) | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 |
Tstart (C) | 60. | 60. | 40. |
Tend (C) | 220. | 220. | 200. |
Heat rate (K/min) | 5. | 5. | 2. |
Initial hold (min) | 10. | 10. | 5. |
Final hold (min) | 20. | ||
I | 1491. | 1491. | 1496. |
Reference | Flamini, Luigi Cioni, et al., 2003 | Flamini, Cioni, et al., 2002 | Kim, Thuy, et al., 2000 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI |
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.
Boti, Koukoua, et al., 2007
Boti, J.B.; Koukoua, G.; N'Guessan, T.Y.; Casanova, J.,
Chemical variability of Conyza sumatrensis and Microglossa pyrifolia from Côte d'Ivoire,
Flavour Fragr. J., 2007, 22, 1, 27-31, https://doi.org/10.1002/ffj.1743
. [all data]
Duquesnoy, Castola, et al., 2007
Duquesnoy, E.; Castola, V.; Casanova, J.,
Composition and chemical variability of the twig oil of Abies alba Miller from Corsica,
Flavour Fragr. J., 2007, 22, 4, 293-299, https://doi.org/10.1002/ffj.1796
. [all data]
Flamini, Tebano, et al., 2007
Flamini, G.; Tebano, M.; Cioni, P.L.,
Volatiles emission patterns of different plant organs and pollen of Citrus limon,
Anal. Chim. Acta., 2007, 589, 1, 120-124, https://doi.org/10.1016/j.aca.2007.02.053
. [all data]
Paolini, Muselli, et al., 2007
Paolini, J.; Muselli, A.; Bernardini, A.-F.; Bighelli, A.; Casanova, J.; Costa, J.,
Thymol derivatives from essential oil of Doronicum corsicum L.,
Flavour Fragr. J., 2007, 22, 6, 479-487, https://doi.org/10.1002/ffj.1824
. [all data]
Sabulal, Dan, et al., 2007
Sabulal, B.; Dan, M.; John, A.; Kurup, R.; Chandrika, S.P.; George, V.,
Phenylbutanoid-rich rhizome oil of Zingiber neesanum from Western Ghats, southern India,
Flavour Fragr. J., 2007, 22, 6, 521-524, https://doi.org/10.1002/ffj.1834
. [all data]
Blagojevic, Radulovic, et al., 2006
Blagojevic, P.; Radulovic, N.; Palic, R.; Stojanovic, G.,
Chemical composition of the essential oils of Serbian wild-growing Srtemisia absinthium and Artemisia vulgaris,
J. Agric. Food Chem., 2006, 54, 13, 4780-4789, https://doi.org/10.1021/jf060123o
. [all data]
Saroglou, Dorizas, et al., 2006
Saroglou, V.; Dorizas, N.; Kypriotakis, Z.; Skaltsa, H.D.,
Analysis of the essential oil composition of eight Anthemis species from Greece,
J. Chromatogr. A, 2006, 1104, 1-2, 313-322, https://doi.org/10.1016/j.chroma.2005.11.087
. [all data]
Vundac, Pfeifhofer, et al., 2006
Vundac, V.B.; Pfeifhofer, H.W.; Brantner, A.H.; Males, Z.; Plazibat, M.,
Essential oils of seven Stachys taxa from Croatia,
Biochem. Syst. Ecol., 2006, 34, 12, 875-881, https://doi.org/10.1016/j.bse.2006.04.010
. [all data]
Zhao C.X., Li, et al., 2006
Zhao C.X.; Li, X.N.; Liang Y.Z.; Fang H.Z.; Huang L.F.; Guo F.Q.,
Comparative analysis of chemical components of essential oils from different samples of Rhododendron with the help of chemometrics methods,
Chemom. Intell. Lab. Syst., 2006, 82, 1-2, 218-228, https://doi.org/10.1016/j.chemolab.2005.08.008
. [all data]
Ziegenbein, Hanssen, et al., 2006
Ziegenbein, F.C.; Hanssen, H.-P.; König, W.A.,
Chemical constituents of the essential oils of three wood-rotting fungi,
Flavour Fragr. J., 2006, 21, 5, 813-816, https://doi.org/10.1002/ffj.1732
. [all data]
Flamini, Luigi Cioni, et al., 2005
Flamini, G.; Luigi Cioni, P.; Morelli, I.,
Composition of the essential oils and in vivo emission of volatiles of four Lamium species from Italy: L. purpureum, L. hybridum, L. bifidum and L. amplexicaule,
Food Chem., 2005, 91, 1, 63-68, https://doi.org/10.1016/j.foodchem.2004.05.047
. [all data]
Seo and Baek, 2005
Seo, W.H.; Baek, H.H.,
Identification of characteristic aroma-active compounds from water dropword (Oenanthe javanica DC.),
J. Agric. Food Chem., 2005, 53, 17, 6766-6770, https://doi.org/10.1021/jf050150z
. [all data]
Flamini, Luigi Cioni, et al., 2004
Flamini, G.; Luigi Cioni, P.; Morelli, I.,
Essential oils of Galeopsis pubescens and G. tetrahit from Tuscany (Italy),
Flavour Fragr. J., 2004, 19, 4, 327-329, https://doi.org/10.1002/ffj.1307
. [all data]
Zheng, Kim, et al., 2004
Zheng, C.H.; Kim, T.H.; Kim, K.H.; Leem, Y.H.; Lee, H.J.,
Characterization of potent aroma compounds in Chrysanthemum coronarium L. (Garland) using aroma extract dilution analysis,
Flavour Fragr. J., 2004, 19, 5, 401-405, https://doi.org/10.1002/ffj.1447
. [all data]
Flamini, Luigi Cioni, et al., 2003
Flamini, G.; Luigi Cioni, P.; Morelli, I.,
Differences in the fragrances of pollen, leaves, and floral parts of garland (Chrysanthemum coronarium) and composition of the essential oils from flowerheads and leaves,
J. Agric. Food Chem., 2003, 51, 8, 2267-2271, https://doi.org/10.1021/jf021050l
. [all data]
Flamini, Cioni, et al., 2002
Flamini, G.; Cioni, P.L.; Morelli, I.,
Differences in the fragrances of pollen and different floral parts of male and female flowers of Laurus nobilis,
J. Agric. Food Chem., 2002, 50, 16, 4647-4652, https://doi.org/10.1021/jf020269x
. [all data]
Kim, Thuy, et al., 2000
Kim, T.H.; Thuy, N.T.; Shin, J.H.; Baek, H.H.; Lee, H.J.,
Aroma-active compounds of miniature beefsteakplant (Mosla dianthera Maxim.),
J. Agric. Food Chem., 2000, 48, 7, 2877-2881, https://doi.org/10.1021/jf000219x
. [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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