Methyl jasmonate
- Formula: C13H20O3
- Molecular weight: 224.2961
- IUPAC Standard InChI:
- InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4+/t10-,11-/m0/s1
- Download the identifier in a file.
- IUPAC Standard InChIKey: GEWDNTWNSAZUDX-NNOMMRTBSA-N
- CAS Registry Number: 1211-29-6
- 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:
- methyl epijasmonate
- Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-, methyl ester, [1«alpha»,2«alpha»(Z)]-
- (+)-Jasmonic acid, methyl ester (cis)
- (-)-Jasmonic acid, methyl ester (trans)
- (+)-(Z)-Methyl epijasmonate
- Methyl (Z)-epi-jasmonate
- cis-Methyl jasmonate
- (E)-methyl jasmonate
- Methyl epi-jasmonate
- (Z)-Methyl epi-jasmonate
- Other names: Cyclopentaneacetic acid, 3-oxo-2-(2-pentenyl)-, methyl ester, [1R-[1«alpha»,2«beta»(Z)]]-; Cyclopentaneacetic acid, 3-oxo-2-(2Z)-2-penten-1-yl-, methyl ester, (1R,2R)-; Cyclopentaneacetic acid, 3-oxo-trans-2-(cis-2-pentenyl), methyl ester; Z-Methyl jasmonoate; Methyl cis-jasmonate; Methyl 2-((1R,2R)-3-oxo-2-((Z)-pent-2-en-1-yl)cyclopentyl)acetate; Methyl (3-oxo-2-[(2Z)-2-pentenyl]cyclopentyl)acetate; 17627-54-2; 54595-01-6; methyl [1R-[1«alpha»,2«beta»(Z)]]-3-oxo-2-(pent-2-enyl)cyclopentaneacetate
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- Information on this page:
- Other data available:
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Normal alkane RI, non-polar column, temperature ramp
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 | Capillary |
|---|---|---|---|---|---|
| Active phase | OV-1 | HP-5 MS | HP-5 | DBP-5 | DBP-5 |
| Column length (m) | 30. | 30. | 30. | 25. | 25. |
| Carrier gas | Helium | Helium | Nitrogen | Helium | Helium |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness ( m) |
0.25 | 0.25 | 0.25 | 0.22 | 0.22 |
| Tstart (C) | 40. | 60. | 50. | 40. | 40. |
| Tend (C) | 300. | 325. | 280. | 250. | 250. |
| Heat rate (K/min) | 4. | 10. | 5. | 3. | 3. |
| Initial hold (min) | 2. | 6. | 1. | 1. | 1. |
| Final hold (min) | 10. | 10. | 1. | 10. | 10. |
| I | 1606. | 1644. | 1615. | 1611. | 1611. |
| Reference | Nibret and Wink, 2009 | Zaibunnisa, Norashikin, et al., 2009 | Bousaada, Ammar, et al., 2008 | Heravi and Sereshti, 2007 | Sereshti and Samadi, 2007 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary |
|---|---|---|---|
| Active phase | DB-5 | CP Sil 5 CB | DB-5 |
| Column length (m) | 30. | 25. | 30. |
| Carrier gas | He | H2 | |
| Substrate | |||
| Column diameter (mm) | 0.25 | 0.25 | 0.32 |
| Phase thickness (m) |
0.25 | 0.5 | |
| Tstart (C) | 60. | 50. | 35. |
| Tend (C) | 200. | 230. | 275. |
| Heat rate (K/min) | 2. | 3. | 6. |
| Initial hold (min) | |||
| Final hold (min) | 60. | ||
| I | 1652. | 1607. | 1638. |
| Reference | Rout, Naik, et al., 2006 | Tesso, König, et al., 2006 | Rouseff, Jella, et al., 2001 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Nibret and Wink, 2009
Nibret, E.; Wink, M.,
Volatile components of four Ethiopian Artemisia species extracts and their in vitro antipatrypanosomal and cytotoxic activities,
Phytomedicine, 2009, 00, 0, 000-000. [all data]
Zaibunnisa, Norashikin, et al., 2009
Zaibunnisa, A.H.; Norashikin, S.; Mamot, S.; Osman, H.,
An experimental design approach for the extraction of volatile compounds from turmeric leaves (Curcuma domestica) using pressurised liquid extraction (PLE),
LWT-Food Sci. Technol., 2009, 42, 1, 233-238, https://doi.org/10.1016/j.lwt.2008.03.015
. [all data]
Bousaada, Ammar, et al., 2008
Bousaada, O.; Ammar, S.; Saidana, D.; Chriaa, J.; Chraif, I.; Daami, M.; Helal, A.N.; Mighri, Z.,
Chemical composition and antimicrobial activity of volatile components from capitula and aerial parts of Rhaponticum acaule DC growing wild in Tunisia,
Microbiol. Res., 2008, 163, 1, 87-95, https://doi.org/10.1016/j.micres.2007.02.010
. [all data]
Heravi and Sereshti, 2007
Heravi, M.J.; Sereshti, H.,
Determination of Essential Oil Components of Artemisia haussknechtii Boiss. using Simultaneous Hydrodistillation-Static Headspace Liquid Phase Microextraction - Gas Chromatography Mass Spectrometry,
J. Chromatogr. A, 2007, 1160, 1-2, 81-89, https://doi.org/10.1016/j.chroma.2007.05.096
. [all data]
Sereshti and Samadi, 2007
Sereshti, H.; Samadi, S.,
Comparison of hydrodistillation-headspace liquid phase microextraction techniques with hydrodistillation in determination of essential oils in Artemisia Haussknechtii Boiss,
JSUT, 2007, 33, 2, 7-17. [all data]
Rout, Naik, et al., 2006
Rout, P.K.; Naik, S.N.; Rao, Y.R.,
Composition of the concrete, absolute, headspace and essential oil of the flowers of Michelia champaca Linn.,
Flavour Fragr. J., 2006, 21, 6, 906-911, https://doi.org/10.1002/ffj.1742
. [all data]
Tesso, König, et al., 2006
Tesso, H.; König, W.A.; Son, P.T.; Giang, P.M.,
Composition of the essential oil of flowers of Chloranthus spicatus (Thunb.) Makino,
Flavour Fragr. J., 2006, 21, 4, 592-597, https://doi.org/10.1002/ffj.1528
. [all data]
Rouseff, Jella, et al., 2001
Rouseff, R.; Jella, P.; Bazemore, R.; Yang, J.-J.,
Aroma active internal standards for gas chromatography-olfactometry of grapefruit juices,
Am. Chem. Soc. Symp. Ser., 2001, 782, 73-87. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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