1,3,6-Heptatriene, 2,5,5-trimethyl-
- Formula: C10H16
- Molecular weight: 136.2340
- IUPAC Standard InChI: InChI=1S/C10H16/c1-6-10(4,5)8-7-9(2)3/h6-8H,1-2H2,3-5H3/b8-7+
- IUPAC Standard InChIKey: BYLJEQIUXOYKOB-BQYQJAHWSA-N
- CAS Registry Number: 29548-02-5
- 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. - Other names: 2,5,5-Trimethyl-1,3,6-heptatriene; 3,3,6-Trimethyl-1,4,6-heptatriene; Artemisia triene
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- Information on this page:
- Other data available:
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Normal alkane RI, non-polar column, custom temperature program
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 |
|---|---|---|---|---|
| Active phase | RTX-1 | CBP-5 | HP-1 | CP Sil 8 CB |
| Column length (m) | 60. | 30. | 30. | 50. |
| Carrier gas | Helium | Helium | He | He |
| Substrate | ||||
| Column diameter (mm) | 0.22 | 0.25 | 0.2 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.33 | 0.25 |
| Program | not specified | 60 0C 3 0C/min -> 240 0C 10 0C/min -> 280 0C (10 min) | 60C(5min) => 3C/min => 180C => 20C/min => 280C(10min) | 60C(2min) => 5C/min => 160C(1min) => 10C/min => 250C (5min) |
| I | 921. | 929. | 924. | 927. |
| Reference | Bendiabdellah, El Amine Dib, et al., 2012 | de Morais, Oliveira, et al., 2012 | Merle, Verdeguer, et al., 2007 | Judzentiene and Buzelyte, 2006 |
| Comment | MSDC-RI | 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.
Bendiabdellah, El Amine Dib, et al., 2012
Bendiabdellah, A.; El Amine Dib, M.; Djabou, N.; Allali, H.; Tabti, B.; Costa, J.; Myseli, A.,
Biological activities and volatile cinstituents of Daucus muricatus L. from Algeria,
Chem. Centr. J., 2012, 6, 48, 1-22. [all data]
de Morais, Oliveira, et al., 2012
de Morais, S.R.; Oliveira, T.L.S.; BAra, M.T.F.; da Conceicao, E.C.; Rezende, M.H.; Ferri, P.H.; de Paula, J.R.,
Chemical constituents of essential oil from Lippia sidoides Cham. (Verbenaceae) leaves cultivated in Hidrolandia, Goias, Brasil,
Int. J. Anal. Chem., 2012, 2012, 1-4, https://doi.org/10.1155/2012/363919
. [all data]
Merle, Verdeguer, et al., 2007
Merle, H.; Verdeguer, M.; Blázquez, M.A.; Boira, H.,
Chemical composition of the essential oils from Eriocephalus africanus L. var. africanus populations growing in Spain,
Flavour Fragr. J., 2007, 22, 6, 461-464, https://doi.org/10.1002/ffj.1821
. [all data]
Judzentiene and Buzelyte, 2006
Judzentiene, A.; Buzelyte, J.,
Chemical composition of essential oils of Artemisia vulgaris L. (mugwort) from North Lithuania,
Chemija, 2006, 17, 1, 12-15. [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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