2,6,10-Dodecatrienal, 3,7,11-trimethyl-, (E,E)-
- Formula: C15H24O
- Molecular weight: 220.3505
- IUPAC Standard InChI: InChI=1S/C15H24O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11-12H,5-6,8,10H2,1-4H3/b14-9+,15-11+
- IUPAC Standard InChIKey: YHRUHBBTQZKMEX-YFVJMOTDSA-N
- CAS Registry Number: 502-67-0
- 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: (E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienal; trans,trans-Farnesal; trans,trans-2,6-Farnesal; E,E-Farnesal; Farnesal, trans,trans-; 2,6-trans-trans-Farnesal; (2E,6E)-Farnesal; (2E,6E)-3,7,11-Trimethyl-2,6,10-dodecatrienal; 3,7,11-trimethyl-2,6,10-Dodecatrienal, (trans,trans)-; Farnesal, (E,E)-; trans-Farnesal; 2,6,10-Dodecatrienal, 3,7,11-trimethyl-, (2E,6E)-; farnesyl aldehyde; 3,7,11-trimethyl-2,6,10-dodecatrienal (farnesal); Farnesal (Isomer 3); Farnesal
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- Other data available:
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Normal alkane RI, non-polar column, custom temperature program
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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
| Column type | Capillary | Capillary | Capillary |
|---|---|---|---|
| Active phase | SLB-5 MS | SLB-5 MS | DB-1 |
| Column length (m) | 30. | 30. | 30. |
| Carrier gas | Helium | Helium | Helium |
| Substrate | |||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 |
| Program | not specified | not specified | not specified |
| I | 1737. | 1745. | 1735. |
| Reference | Mondello, 2012 | Mondello, 2012 | Xu, Tang, et al., 2010 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Mondello, 2012
Mondello, L.,
HS-SPME-GCxGC-MS analysis of Yerba Mate (Ilex paraguariensis)
in Shimadzu GC-GC application compendium of comprehensive 2D GC, Vol. 1-5, Shimadzu Corp., 2012, 1-29. [all data]
Xu, Tang, et al., 2010
Xu, X.; Tang, Z.; Liang, Y.,
Comparative analysis of plant essential oils by GC-MS coupled with integrated chemometric resolution methods,
Anal. Methods, 2010, 2, 4, 359-367, https://doi.org/10.1039/b9ay00213h
. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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