(2E,4E)-Methyl 3,7-dimethylocta-2,4,6-trienoate
- Formula: C11H16O2
- Molecular weight: 180.2435
- IUPAC Standard InChI: InChI=1S/C11H16O2/c1-9(2)6-5-7-10(3)8-11(12)13-4/h5-8H,1-4H3/b7-5+,10-8+
- IUPAC Standard InChIKey: MUIMRDAQSNCVEQ-RMTFUQJTSA-N
- CAS Registry Number: 53771-48-5
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: 2,4,6-Octatrienoic acid, 3,7-dimethyl-, methyl ester, (2E,4E)-; 2,4,6-Octatrienoic acid, 3,7-dimethyl-, methyl ester, (E,E)-; Methyl dehydrogeraniate
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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, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-1 | 1445. | Raharivelomanana, Cambon, et al., 1993 | 6. K/min, 240. C @ 10. min; Column length: 15. m; Column diameter: 0.32 mm; Tstart: 40. C |
Van Den Dool and Kratz RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-5MS | 1475.3 | Andriamaharavo, 2014 | 30. m/0.25 mm/0.25 μm, He; Program: 60C (1 min) => 5 C/min => 210C => 10 C/min => 280C (15 min) |
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.
Raharivelomanana, Cambon, et al., 1993
Raharivelomanana, P.; Cambon, A.; Azzaro, M.; Bianchini, J.-P.; Claude-Lafontaine, A.; George, G.,
Volatile Constituents of Neocallitropsis pancheri (Carriere) de Laubenfels Heartwood Extracts (Cupressaceae),
J. Essent. Oil Res., 1993, 5, 6, 587-595, https://doi.org/10.1080/10412905.1993.9698289
. [all data]
Andriamaharavo, 2014
Andriamaharavo, N.R.,
Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2014. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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