Geranyl tiglate
- Formula: C15H24O2
- Molecular weight: 236.3499
- IUPAC Standard InChI: InChI=1S/C15H24O2/c1-6-14(5)15(16)17-11-10-13(4)9-7-8-12(2)3/h6,8,10H,7,9,11H2,1-5H3/b13-10+,14-6+
- IUPAC Standard InChIKey: OGHBUHJLMHQMHS-KRDNBFTESA-N
- CAS Registry Number: 7785-33-3
- 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: 2-Butenoic acid, 2-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (E,E)-; 2,6-Octadien-1-ol, 3,7-dimethyl-, 2-methyl-2-butenoate, (E,E)--; cis-α,β-Dimethyl acrylic acid, geraniol ester; trans-3,7-Dimethyl-2,6-octadien-1-yl cis-α,β-dimethyl acrylate; Tiglic acid, geraniol ester; (2E)-3,7-Dimethyl-2,6-octadienyl (2E)-2-methyl-2-butenoate; (E)-(E)-3,7-Dimethylocta-2,6-dien-1-yl 2-methylbut-2-enoate; (E)-3,7-Dimethylocta-2,6-dienyl (E)-2-methylbut-2-enoate; Gernyl tiglate; Geranyl (E)-2-methyl-2-butenoate; (E)-3,7-dimethyl-2,6-octadienyl 2-methylcrotonate
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Options:
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 |
|---|---|---|---|
| Active phase | HP-5 MS | DB-1 | SE-30 |
| Column length (m) | 30. | 60. | |
| Carrier gas | Helium | Helium | |
| Substrate | |||
| Column diameter (mm) | 0.25 | 0.25 | |
| Phase thickness (μm) | 0.25 | 0.25 | |
| Program | 60 0C (1 min) 10 0C/min -> 180 0C (1 min) 20 0C/min -> 280 0C (15 min) | 50 0C (5 min) 3 0C/min -> 120 0C 5 0C/min -> 250 0C (3 min) 15 0C/min -> 300 0C (20 min) | not specified |
| I | 1700. | 1673. | 1659. |
| Reference | Bai, Liu, et al., 2011 | Delort and Jaquier, 2009 | Vinogradov, 2004 |
| 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.
Bai, Liu, et al., 2011
Bai, C.Q.; Liu, Z.L.; Liu, Q.Z.,
Nematicidal constituents from the essential oil of Chenopodium ambrosioides aerial parts,
E-Journal of Chemistry, 2011, 8, S1, s143-s148, https://doi.org/10.1155/2011/470862
. [all data]
Delort and Jaquier, 2009
Delort, E.; Jaquier, A.,
Novel terpenyl esters from Australian finger lime (Citrus australasica) peel extract,
Flav. Fragr. J., 2009, 24, 3, 123-132, https://doi.org/10.1002/ffj.1922
. [all data]
Vinogradov, 2004
Vinogradov, B.A.,
Production, composition, properties and application of essential oils, 2004, retrieved from http://viness.narod.ru. [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
- The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
- Customer support for NIST Standard Reference Data products.