2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, acetate, cis-
- Formula: C12H18O2
- Molecular weight: 194.2701
- IUPAC Standard InChI: InChI=1S/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3/t11-,12-/m0/s1
- IUPAC Standard InChIKey: YTHRBOFHFYZBRJ-RYUDHWBXSA-N
- CAS Registry Number: 1205-42-1
- 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: p-Mentha-6,8-dien-2-ol, acetate, cis-; cis-Carvyl acetate; Carvyl acetate (Z); Z-Carvyl acetate; 2-Cyclohexen-1-ol, 2-methyl-5-(1-methylethenyl)-, 1-acetate, (1R,5R)-rel-; cis-Carveyl acetate; cis-Carveol acetate; cis-Carveol, O-(acetyl)-; cis-2-methyl-5-(1-methylvinyl)cyclohex-2-en-1-yl acetate
- 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, 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 | HP-5 | RTX-1 | RTX-1 | DB-5 | HP-5 |
| Column length (m) | 30. | 60. | 60. | 30. | 30. |
| Carrier gas | Helium | Helium | Helium | Nitrogen | Helium |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.22 | 0.22 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.32 |
| Tstart (C) | 50. | 60. | 60. | 60. | 60. |
| Tend (C) | 240. | 230. | 230. | 240. | 250. |
| Heat rate (K/min) | 3. | 2. | 2. | 3. | 5. |
| Initial hold (min) | 5. | 1. | 30. | ||
| Final hold (min) | 30. | 30. | 9. | ||
| I | 1367. | 1315. | 1318. | 1363. | 1360. |
| Reference | Monsef-Esfahani, Miri, et al., 2010 | Museli, Pau, et al., 2009 | Museli, Pau, et al., 2009 | Jardin, Jham, et al., 2008 | Yassa and Akhani, 2008 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | SPB-5 | HP-5 MS | HP-5 | HP-1 | Methyl Silicone |
| Column length (m) | 30. | 30. | 30. | 50. | 25. |
| Carrier gas | He | Helium | He | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.2 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.32 | 0.33 | 0.25 |
| Tstart (C) | 50. | 60. | 60. | 60. | 90. |
| Tend (C) | 250. | 280. | 250. | 250. | 220. |
| Heat rate (K/min) | 2. | 3. | 5. | 2. | 7. |
| Initial hold (min) | 30. | 2. | |||
| Final hold (min) | 40. | ||||
| I | 1366. | 1368. | 1360. | 1340. | 1360. |
| Reference | Raal, Orav, et al., 2007 | Vagionas, Graikou, et al., 2007 | Yassa and Akhani, 2007 | Filippi, Lanfranchi, et al., 2006 | Kitchlu, Bakshi, et al., 2006 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | HP-5 | PE-5 | HP-5MS | DB-1 | DB-5 |
| Column length (m) | 30. | 30. | 30. | 50. | 60. |
| Carrier gas | He | H2 | He | N2 | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.25 | 0.25 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | ||
| Tstart (C) | 60. | 60. | 60. | 95. | 50. |
| Tend (C) | 240. | 230. | 280. | 240. | 220. |
| Heat rate (K/min) | 5. | 5. | 3. | 4. | 3. |
| Initial hold (min) | 2. | ||||
| Final hold (min) | 4. | ||||
| I | 1362. | 1322. | 1362. | 1366. | 1395. |
| Reference | Saeidnia, Gohari, et al., 2005 | Singh, Raina, et al., 2005 | Mimica-Dukic, Bozin, et al., 2004 | Palá-Paúl, Velasco-Negueruela, et al., 2004 | Edris, Shalaby, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | HP-5 | CP Sil 5 CB | SE-54 | HP-5 | DB-5 |
| Column length (m) | 30. | 25. | 30. | 30. | 30. |
| Carrier gas | Helium | He | H2 | N2 | H2 |
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.25 | 0.32 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | ||
| Tstart (C) | 70. | 60. | 40. | 60. | 60. |
| Tend (C) | 210. | 220. | 240. | 220. | 285. |
| Heat rate (K/min) | 2. | 5. | 5. | 5. | 3. |
| Initial hold (min) | 10. | ||||
| Final hold (min) | 60. | ||||
| I | 1362. | 1349. | 1364. | 1364. | 1362. |
| Reference | Mookdasanit, Tamura, et al., 2003 | Monfared, Davarani, et al., 2002 | Silva A.D., Patitucci M.L., et al., 2002 | Gallori, Flamini, et al., 2001 | Santos-Gomes and Fernandes-Ferreira, 2001 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | OV-101 | RTX-1 | SPB-5 | OV-101 | OV-101 |
| Column length (m) | 50. | 30. | 50. | 50. | 50. |
| Carrier gas | N2 | N2 | He | ||
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | |||
| Tstart (C) | 80. | 60. | 60. | 80. | 80. |
| Tend (C) | 200. | 300. | 240. | 200. | 200. |
| Heat rate (K/min) | 2. | 4. | 3. | 2. | 2. |
| Initial hold (min) | |||||
| Final hold (min) | 20. | ||||
| I | 1311. | 1346. | 1363. | 1311. | 1315. |
| Reference | Yang, 2001 | Kalemba, 1999 | Doneanu and Anitescu, 1998 | Tamura, Yang, et al., 1993 | Tamura, Yang, et al., 1993 |
| 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.
Monsef-Esfahani, Miri, et al., 2010
Monsef-Esfahani, H.R.; Miri, A.; Amini, M.; Amanzadeh, Y.; Hadjiakhoondi, A.; Hajiaghaee, R.; Ajani, Y.,
Seasonal variations in the chemical composition, antioxidant activity and total phenolic content of Teucrium persicum Boiss. essential oils,
Res. J. Biol. Sci., 2010, 5, 7, 492-498, https://doi.org/10.3923/rjbsci.2010.492.498
. [all data]
Museli, Pau, et al., 2009
Museli, A.; Pau, M.; Desjobert, J.-M.; Foddai, M.; Usai, M.; Costa, J.,
Volatile constituents of Achllea ligustica All. by HS-SPME/GC/GC-MS. Comparison with essential oils obtained by hydrodistillation from Corsica and Sardinia,
Chromatographia, 2009, 69, 5/6, 575-585, https://doi.org/10.1365/s10337-008-0939-1
. [all data]
Jardin, Jham, et al., 2008
Jardin, C.M.; Jham, G.N.; Dhingra, O.D.; Freire, M.M.,
Composition and Antifungal activity of the essential oil of the Brazilian Chenopodium ambrosioides L.,
J. Chem. Ecol., 2008, 34, 9, 1213-1218, https://doi.org/10.1007/s10886-008-9526-z
. [all data]
Yassa and Akhani, 2008
Yassa, N.; Akhani, H.,
The essential oils composition in two species of the genus Eriocycla Lindl. (Apiaceae) from Iran, 2008, retrieved from http://biology.ut.ac.ir/members/akhani/PdfReprintNumber/27.pdf. [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]
Vagionas, Graikou, et al., 2007
Vagionas, K.; Graikou, K.; Ngassapa, O.; Runyoro, D.; Chinou, I.,
Composition and antimicrobial activity of the essential oils of three Satureja species growing in Tansania,
Food Chem., 2007, 103, 2, 319-324, https://doi.org/10.1016/j.foodchem.2006.07.051
. [all data]
Yassa and Akhani, 2007
Yassa, N.; Akhani, H.,
The essential oils composition in two species of the genus Eriocycla Lindl. (Apiaceae) from Iran, 2007, retrieved from http://biology.ut.ac.ir/members/akhani/PdfReprintNumber/27.pdf. [all data]
Filippi, Lanfranchi, et al., 2006
Filippi, J.-J.; Lanfranchi, D.-A.; Prado, S.; Baldovini, N.; Meierhenrich, U.J.,
Composition, Enantiomeric Distribution, and Antibacterial Activity of the Essential Oil of Achillea ligustica All. from Corsica,
J. Agric. Food Chem., 2006, 54, 17, 6308-6313, https://doi.org/10.1021/jf060752y
. [all data]
Kitchlu, Bakshi, et al., 2006
Kitchlu, S.; Bakshi, S.K.; Kaul, M.K.; Bhan, M.K.; Thapa, R.K.; Agarwal, S.G.,
Tanacetum gracile Hook. f T. A new source of lavandulol from Ladakh Himalaya (India),
Flavour Fragr. J., 2006, 21, 4, 690-692, https://doi.org/10.1002/ffj.1674
. [all data]
Saeidnia, Gohari, et al., 2005
Saeidnia, S.; Gohari, A.R.; Yassa, N.; Shafiee, A.,
Composition of the volatile oil of Achillea conferta DC. from Iran,
DARU, 2005, 13, 1, 34-36. [all data]
Singh, Raina, et al., 2005
Singh, A.K.; Raina, V.K.; Naqvi, A.A.; Patra, N.K.; Kumar, B.; Ram, P.; Khanuja, S.P.S.,
Essential oil composition and chemoarrays of menthol mint (Mentha arvensis L. f. piperascens Malinvaud ex. Holmes) cultivars,
Flavour Fragr. J., 2005, 20, 3, 302-305, https://doi.org/10.1002/ffj.1417
. [all data]
Mimica-Dukic, Bozin, et al., 2004
Mimica-Dukic, N.; Bozin, B.; Sokovic, M.; Simin, N.,
Antimicrobial and antioxidant activities of Melissa officinalis L. (Lamiaceae) essential oil,
J. Agric. Food Chem., 2004, 52, 9, 2485-2489, https://doi.org/10.1021/jf030698a
. [all data]
Palá-Paúl, Velasco-Negueruela, et al., 2004
Palá-Paúl, J.; Velasco-Negueruela, A.; Pérez-Alonso, M.J.; Maqueda, J.; Sanz, J.,
Volatile oil constituents from different parts of Cachrys trifida L.,
J. Essent. Oil Res., 2004, 16, 4, 347-349, https://doi.org/10.1080/10412905.2004.9698738
. [all data]
Edris, Shalaby, et al., 2003
Edris, A.E.; Shalaby, A.S.; Fadel, H.M.; Abdel-Wahab, M.A.,
Evaluation of a chemotype of spearmint (Mentha spicata L.) grown in Siwa Oasis, Egypt,
Eur. Food Res. Technol., 2003, 218, 1, 74-78, https://doi.org/10.1007/s00217-003-0802-4
. [all data]
Mookdasanit, Tamura, et al., 2003
Mookdasanit, J.; Tamura, H.; Yoshizawa T.; Tokunaga T.; Nakanishi, K.,
Trace Volatile Compounds in Essential Oil of Citrus Sudachi by Means of Modified Solvent Extraction Method,
Food Sci Technol. Res., 2003, 9, 1, 54-61, https://doi.org/10.3136/fstr.9.54
. [all data]
Monfared, Davarani, et al., 2002
Monfared, A.; Davarani, S.S.H.; Rustaiyan, A.; Masoudi, S.,
Composition of the essential oil of Tanacetum balsamita L. ssp. balsamitoides (Schultz Bip.) Grierson from Iran,
J. Essent. Oil Res., 2002, 14, 1, 1-2, https://doi.org/10.1080/10412905.2002.9699741
. [all data]
Silva A.D., Patitucci M.L., et al., 2002
Silva A.D.; Patitucci M.L.; Bizzo H.R.; D'Elia E.; Antunes O.A.C.,
Wacker PdCl2-CuCl2 catalytic oxidation process: Oxidation of limonene,
Catalysis Communications, 2002, 3, 9, 435-440, https://doi.org/10.1016/S1566-7367(02)00174-7
. [all data]
Gallori, Flamini, et al., 2001
Gallori, S.; Flamini, G.; Bilia, A.R.; Morelli, I.; Landini, A.; Vincieri, F.F.,
Chemical composition of some traditional herbal drug preparations: essential oil and aromatic water of costmary (Balsamita suaveolens Pers.),
J. Agric. Food Chem., 2001, 49, 12, 5907-5910, https://doi.org/10.1021/jf0107656
. [all data]
Santos-Gomes and Fernandes-Ferreira, 2001
Santos-Gomes, P.C.; Fernandes-Ferreira, M.,
Organ- and season-dependent variation in the essential oil composition of Salvia officinalis L. cultivated at two different sites,
J. Agric. Food Chem., 2001, 49, 6, 2908-2916, https://doi.org/10.1021/jf001102b
. [all data]
Yang, 2001
Yang, R.,
Analysis of the volatile components in peel oil of Yuzu by gas chromatography/mass spectrometry,
Chin. J. Anal. Chem., 2001, 29, 3, 313-316. [all data]
Kalemba, 1999
Kalemba, D.,
Constituents of the essential oil of Artemisia asiatica Nakai,
Flavour Fragr. J., 1999, 14, 3, 173-176, https://doi.org/10.1002/(SICI)1099-1026(199905/06)14:3<173::AID-FFJ805>3.0.CO;2-Q
. [all data]
Doneanu and Anitescu, 1998
Doneanu, C.; Anitescu, G.,
Supercritical carbon dioxide extraction of Angelica archangelica L. root oil,
J. Supercrit. Fluids, 1998, 12, 1, 59-67, https://doi.org/10.1016/S0896-8446(97)00040-5
. [all data]
Tamura, Yang, et al., 1993
Tamura, H.; Yang, R.-H.; Sugisawa, H.,
Aroma profiles of peel oils of acid citrus,
ACS Sym. Ser., 1993, 525, 121-136. [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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