2,6-Octadienoic acid, 3,7-dimethyl-, (E)-
- Formula: C10H16O2
- Molecular weight: 168.2328
- IUPAC Standard InChI: InChI=1S/C10H16O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,7H,4,6H2,1-3H3,(H,11,12)/b9-7+
- IUPAC Standard InChIKey: ZHYZQXUYZJNEHD-VQHVLOKHSA-N
- CAS Registry Number: 4698-08-2
- 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:
- Stereoisomers:
- Other names: (E)-3,7-Dimethylocta-2,6-dienoic acid; Geranic acid; Geranoic acid; trans-geranic acid; trans-geranic acid (trans-3,7-dimethyl-2,6-octadien-1-oic acid); Geranilyc acid; trans-geranoic acid
- Information on this page:
- Other data available:
- Options:
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 | Packed |
|---|---|---|---|---|
| Active phase | HP-5 | DB-5 | 5 % Phenyl methyl siloxane | OV-101 |
| Column length (m) | 30. | 30. | 2.5 | |
| Carrier gas | He | N2 | ||
| Substrate | Chromosorb G 60-80mesh DMCS | |||
| Column diameter (mm) | 0.25 | 0.25 | ||
| Phase thickness (μm) | 0.25 | 0.25 | ||
| Program | 40 0C (2 min) 5 0C/min -> 80 0C 7 oC/min -> 160 0C 9 0C/min -> 200 0C 20 0C/min -> 280 0C (10 min) | 80 0C (1 min) 3 0C/min -> 180 0C 10 0C/min -> 300 0C (3 min) | not specified | not specified |
| I | 1355. | 1354. | 1348. | 1347. |
| Reference | Zhao, Li, et al., 2008 | Blank, Fontes, et al., 2005 | Sagrero-Nieves and Bartley, 1995 | Swigar and Silverstein, 1981 |
| 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.
Zhao, Li, et al., 2008
Zhao, Y.; Li, J.; Xu, Y.; Duan, H.; Fan, W.; Zhao, G.,
EXtraction, preparation and identification of volatile compounds in Changyu XO brandy,
Chinese J. Chromatogr., 2008, 26, 2, 212-222, https://doi.org/10.1016/S1872-2059(08)60014-0
. [all data]
Blank, Fontes, et al., 2005
Blank, A.F.; Fontes, S.M.; Carvalho Filho, J.L.S.; Alves, P.B.; Silva-Mann, R.; Mendonça, M.C.; Arrigoni-Blank, M.F.; Rodrigues, M.O.,
Influence of harvest times and drying of leaves on the essential oil of Melissa officinalis L. cultivated in two environments,
Rev. Bras. Pl. Med., Botucatu, 2005, 8, 1, 73-78. [all data]
Sagrero-Nieves and Bartley, 1995
Sagrero-Nieves, L.; Bartley, J.P.,
Volatile Constituents from the Leaves of Chenopodium ambrosioides L.,
J. Essent. Oil Res., 1995, 7, 2, 221-223, https://doi.org/10.1080/10412905.1995.9698506
. [all data]
Swigar and Silverstein, 1981
Swigar, A.A.; Silverstein, R.M.,
Monoterpenes, Aldrich Chemical Company, Milwaukee, WI, USA, 1981, 130. [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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