Myrtenyl acetate
- Formula: C12H18O2
- Molecular weight: 194.2701
- IUPAC Standard InChI: InChI=1S/C12H18O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3
- IUPAC Standard InChIKey: BKATZVAUANSCKN-UHFFFAOYSA-N
- CAS Registry Number: 1079-01-2
- 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. - Other names: 2-Pinen-10-ol, acetate; Bicyclo[3.1.1]hept-2-ene-2-methanol, 6,6-dimethyl-, acetate, (1S)-; (1S)-6,6-Dimethylbicyclo(3.1.1)hept-2-ene-2-methanol acetate; (+)-Myrtenyl acetate; myrtenalacetate; (1S)-(6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl)methyl acetate
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- Information on this page:
- Other data available:
- Options:
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 | RTX-1 | DB-5 MS | HP-5MS | ZB-1 | DB-5 |
| Column length (m) | 60. | 25. | 30. | 30. | 60. |
| Carrier gas | Helium | Helium | Helium | Nitrogen | Nitrogen |
| Substrate | |||||
| Column diameter (mm) | 0.22 | 0.30 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 60. | 50. | 50. | 45. | 60. |
| Tend (C) | 230. | 240. | 240. | 230. | 250. |
| Heat rate (K/min) | 2. | 3. | 5. | 3. | 5. |
| Initial hold (min) | |||||
| Final hold (min) | 5. | 10. | |||
| I | 1332. | 1324. | 1335. | 1304. | 1332. |
| Reference | Bendiabdellah, El Amine Dib, et al., 2012 | Chalchat, Figueredo, et al., 2010 | Wannes, Mhamdi, et al., 2009 | Mierendorff, Stahl-Biskup, et al., 2008 | Mosayebi, Amin, et al., 2008 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-1 | SPB-5 | DB-1 | HP-5MS | HP-5MS |
| Column length (m) | 60. | 30. | 60. | 30. | 30. |
| Carrier gas | Nitrogen | He | Nitrogen | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 60. | 50. | 60. | 40. | 50. |
| Tend (C) | 250. | 250. | 250. | 260. | 250. |
| Heat rate (K/min) | 4. | 2. | 4. | 4. | 2. |
| Initial hold (min) | 1. | 1. | |||
| Final hold (min) | 10. | 10. | |||
| I | 1285. | 1324. | 1285. | 1323.0 | 1335. |
| Reference | Ghasempour, Shirinpour, et al., 2007 | Raal, Orav, et al., 2007 | Reza, Ebrahim, et al., 2007 | Zizovic, Stamenic, et al., 2007 | Farah, Afifi, et al., 2006 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 | CP Sil 5 CB | NB-30 | ZB-1 | CP Sil 5 CB |
| Column length (m) | 25. | 30. | 50. | 30. | 25. |
| Carrier gas | N2 | N2 | He | N2 | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.2 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.15 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 50. | 50. | 50. | 45. | 60. |
| Tend (C) | 200. | 200. | 250. | 230. | 300. |
| Heat rate (K/min) | 4. | 5. | 2. | 3. | 6. |
| Initial hold (min) | 3. | ||||
| Final hold (min) | |||||
| I | 1332. | 1312. | 1310. | 1304. | 1299. |
| Reference | Ouamba, Ouabonzi, et al., 2006 | Agnaniet, Menut, et al., 2004 | Raal, Arak, et al., 2004 | Mierendorff, Stahl-Biskup, et al., 2003 | Bos, Woerdenbag, et al., 1997 |
| Comment | MSDC-RI | MSDC-RI | 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.
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]
Chalchat, Figueredo, et al., 2010
Chalchat, J.-C.; Figueredo, G.; Ozcan, M.M.; Unver, A.,
Effect of hydrodistillation and microwave distillation extraction methods on chemical composition of essential oil of pickling herb and myrtle plants,
South Western J. of Agriculture, 2010, 1, 2, 133-141. [all data]
Wannes, Mhamdi, et al., 2009
Wannes, W.A.; Mhamdi, B.; Marzouk, B.,
GC comparative analysis of least essential oils from two Myrtle varieties at different phenological stages,
Chromatographia, 2009, 69, 1/2, 145-150, https://doi.org/10.1365/s10337-008-0818-9
. [all data]
Mierendorff, Stahl-Biskup, et al., 2008
Mierendorff, H.-G.; Stahl-Biskup, E.; Posthumus, M.A.; van Beek, T.A.,
Composition of commercial Cape chamomile oil (Eriocephalus punctuatus / Eriocephalus tenuifolius), 2008, retrieved from http://www.chemische-analysen-hamburg.de/Publikationen?CapeChamomileOil/. [all data]
Mosayebi, Amin, et al., 2008
Mosayebi, M.; Amin, G.; Arzani, H.; Azarnivand, H.; Maleki, M.; Shafaghat, A.,
Effect of habitat on essential oil of Achillea filipendula L. in Iran,
Asian J. Plant Sci., 2008, 7, 8, 779-781, https://doi.org/10.3923/ajps.2008.779.781
. [all data]
Ghasempour, Shirinpour, et al., 2007
Ghasempour, H.R.; Shirinpour, E.; Heidari, H.,
The constituents of essential oils of Ferulago angulata (Schlecht.) Boiss at two different habitats, Nevakoh and Shahoo, Agross mountain, Western Iran,
Iranian J. Sci. Technol., 2007, 31, A3, 309-312. [all data]
Raal, Orav, et al., 2007
Raal, A.; Orav, A.; Arak, E.; Kailas, T.; Müürisepp, M.,
Variation in the composition of the essential oil of Valeriana officinalis L. roots from Estonia,
Proc. Est. Acad. Sci. Chem., 2007, 56, 2, 67-74. [all data]
Reza, Ebrahim, et al., 2007
Reza, G.H.; Ebrahim, S.; Hossein, H.,
Analysis by gas chromatography - mass spectrometry of essential oil from seeds and aerial parts of Ferulago angulata (Schlecht.) Boiss gatheres in Nevakoh and Shahoo, Zagross mountain, west of Iran,
Pakistan J. Biol. Sci., 2007, 10, 5, 814-817, https://doi.org/10.3923/pjbs.2007.814.817
. [all data]
Zizovic, Stamenic, et al., 2007
Zizovic, I.; Stamenic, M.; Ivanovic, J.; Orlovic, A.; Ristic, M.; Djordjevic, S.; Petrovic, S.D.; Skala, D.,
Supercritical carbon dioxide extraction of sesquiterpenes from valerian root,
J. Supercrit. Fluids, 2007, 43, 2, 249-258, https://doi.org/10.1016/j.supflu.2007.05.007
. [all data]
Farah, Afifi, et al., 2006
Farah, A.; Afifi, A.; Fechtal, M.; Chhen, A.; Satrani, B.; Talbi, M.; Chaouch, A.,
Fractional distillation effect on the chemical composition of Moroccan myrtle (Myrtus communis L.) essential oils,
Flavour Fragr. J., 2006, 21, 2, 351-354, https://doi.org/10.1002/ffj.1651
. [all data]
Ouamba, Ouabonzi, et al., 2006
Ouamba, J.-M.; Ouabonzi, A.; Ekouya, A.; Bessière, J.-M.; Menut, C.; Abena, A.A.; Banzouzi, J.-T.,
Volatile constituents of the essential oil leaf of Lantana salvifolia Jacq. (Verbenaceae),
Flavour Fragr. J., 2006, 21, 1, 158-161, https://doi.org/10.1002/ffj.1553
. [all data]
Agnaniet, Menut, et al., 2004
Agnaniet, H.; Menut, C.; Bessière, J.-M.,
Aromatic plants of tropical central Africa. Part XLIX: chemical composition of essential oils of the leaf and rhizome of Aframomum giganteum K. Schum from Gabon,
Flavour Fragr. J., 2004, 19, 3, 205-209, https://doi.org/10.1002/ffj.1403
. [all data]
Raal, Arak, et al., 2004
Raal, A.; Arak, E.; Orav, A.,
Chemical composition of coriander seed essential oil and their conformity with EP standards,
Agraarteadus, 2004, 15, 4, 234-239. [all data]
Mierendorff, Stahl-Biskup, et al., 2003
Mierendorff, H.-G.; Stahl-Biskup, E.; Posthumus, M.A.; van Beek, T.A.,
Composition of commercial Cape chamomile oil (Eriocephalus punctulatus),
Flavour Fragr. J., 2003, 18, 6, 510-514, https://doi.org/10.1002/ffj.1259
. [all data]
Bos, Woerdenbag, et al., 1997
Bos, R.; Woerdenbag, H.J.; Hendriks, H.; Scheffer, J.J.C.,
Composition of the essential oils from underground parts of Valeriana officinalis L. s.l. and several closely related taxa,
Flavour Fragr. J., 1997, 12, 5, 359-370, https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<359::AID-FFJ660>3.0.CO;2-G
. [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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