trans-Sabinyl acetate
- Formula: C12H18O2
- Molecular weight: 194.2701
- IUPAC Standard InChI: InChI=1S/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3/t10?,11-,12+/m1/s1
- IUPAC Standard InChIKey: PBWRFXQNNGSAQG-SAIIYOCFSA-N
- Chemical structure:
This structure is also available as a 2d Mol file - Stereoisomers:
- Other names: (E)-Sabinyl acetate; Sabinyl acetate, trans
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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 | RTX-1 | CP Sil 5 CB | HP-5MS | HP-1 |
| Column length (m) | 60. | 60. | 30. | 30. | 50. |
| Carrier gas | Helium | Helium | N2 | He | |
| Substrate | |||||
| Column diameter (mm) | 0.22 | 0.22 | 0.32 | 0.25 | 0.2 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.33 |
| Tstart (C) | 60. | 60. | 60. | 60. | 60. |
| Tend (C) | 230. | 230. | 300. | 280. | 250. |
| Heat rate (K/min) | 2. | 2. | 4. | 4. | 2. |
| Initial hold (min) | |||||
| Final hold (min) | 30. | 30. | 40. | ||
| I | 1274. | 1278. | 1278. | 1294. | 1272. |
| Reference | Museli, Pau, et al., 2009 | Museli, Pau, et al., 2009 | Baran, von Reuss, et al., 2007 | Ebrahim Sajjadi and Mehregan, 2006 | Filippi, Lanfranchi, et al., 2006 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | NB-30 | HP-5 | DB-1 | DB-5 | DB-1 |
| Column length (m) | 30. | 30. | 60. | 30. | 60. |
| Carrier gas | He | He | He | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.2 | 0.25 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 50. | 60. | 50. | 60. | 50. |
| Tend (C) | 250. | 220. | 250. | 220. | 250. |
| Heat rate (K/min) | 2. | 5. | 4. | 3. | 4. |
| Initial hold (min) | 10. | 4. | |||
| Final hold (min) | |||||
| I | 1273. | 1323. | 1271. | 1292. | 1271. |
| Reference | Orav, Raal, et al., 2006 | Pintore G., Chessa M., et al., 2006 | Rasooli and Owlia, 2005 | Salehi, Sefidkon, et al., 2005 | Rasooli and Razzaghi Abyaneh, 2004 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 | HP-5MS | RTX-5Sil | HP-5 | HP-5 |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | He | He | He | 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) | 35. | 60. | 70. | 60. | 60. |
| Tend (C) | 220. | 275. | 200. | 275. | 280. |
| Heat rate (K/min) | 2.5 | 4. | 4. | 4. | 3. |
| Initial hold (min) | |||||
| Final hold (min) | 6. | 10. | |||
| I | 1291. | 1291. | 1298. | 1296. | 1275. |
| Reference | Rohloff, Mordal, et al., 2004 | Afsharypuor and Jahromy, 2003 | Dudai, Larkov, et al., 2003 | Ghannadi and Zolfaghari, 2003 | Pitarokili, Tzakou, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary |
|---|---|---|---|
| Active phase | DB-5 | DB-1 | CP Sil 5 CB |
| Column length (m) | 30. | 25. | 25. |
| Carrier gas | He | He | |
| Substrate | |||
| Column diameter (mm) | 0.249 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | |
| Tstart (C) | 60. | 50. | 60. |
| Tend (C) | 300. | 290. | 280. |
| Heat rate (K/min) | 3. | 4. | 5. |
| Initial hold (min) | |||
| Final hold (min) | 5. | ||
| I | 1290. | 1290. | 1282. |
| Reference | Bos, Koulman, et al., 2002 | Koulman, 1999 | Kaul, Singh, et al., 1993 |
| 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.
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]
Baran, von Reuss, et al., 2007
Baran, S.; von Reuss, S.H.; König, W.A.; Kalemba, D.,
Composition of the essential oil of Abies koreana Wils.,
Flavour Fragr. J., 2007, 22, 1, 78-83, https://doi.org/10.1002/ffj.1762
. [all data]
Ebrahim Sajjadi and Mehregan, 2006
Ebrahim Sajjadi, S.; Mehregan, I.,
Volatile constituents of flowers and leaves of Anthemis hyalina,
Chem. Nat. Compd. (Engl. Transl.), 2006, 42, 5, 531-533, https://doi.org/10.1007/s10600-006-0207-2
. [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]
Orav, Raal, et al., 2006
Orav, A.; Raal, A.; Arak, E.; Müürisepp, M.; Kailas, T.,
Composition of the essential oil of Artemisia absinthium L. of different geographical origin,
Proc. Est. Acad. Sci. Chem., 2006, 55, 3, 155-165. [all data]
Pintore G., Chessa M., et al., 2006
Pintore G.; Chessa M.; Manconi P.; Zanetti S.; Deriu A.; Tirillini B.,
Chemical composition and antimicrobial activities of essential oil of stachys glutinosa L. from Sardinia,
Natural Product Communications, 2006, 1, 12, 1133-1136. [all data]
Rasooli and Owlia, 2005
Rasooli, I.; Owlia, P.,
Chemoprevention by thyme oils of Aspergillus parasiticus growth and aflatoxin production,
Phytochemistry, 2005, 66, 24, 2851-2856, https://doi.org/10.1016/j.phytochem.2005.09.029
. [all data]
Salehi, Sefidkon, et al., 2005
Salehi, P.; Sefidkon, F.; Bazzaz Tolami, L.; Sonboli, A.,
Essential oil composition of Salvia palaestina Benth. from Iran,
Flavour Fragr. J., 2005, 20, 5, 525-527, https://doi.org/10.1002/ffj.1448
. [all data]
Rasooli and Razzaghi Abyaneh, 2004
Rasooli, I.; Razzaghi Abyaneh, M.,
Inhibitory effects of Thyme oils on growth and aflatoxin production by Aspergillus parasiticus,
Food Control, 2004, 15, 6, 479-483, https://doi.org/10.1016/j.foodcont.2003.07.002
. [all data]
Rohloff, Mordal, et al., 2004
Rohloff, J.; Mordal, R.; Dragland, S.,
Chemotypical variation of tansy (Tanacetum vulgare L.) from 40 different locations in Norway,
J. Agric. Food Chem., 2004, 52, 6, 1742-1748, https://doi.org/10.1021/jf0352430
. [all data]
Afsharypuor and Jahromy, 2003
Afsharypuor, S.; Jahromy, M.M.,
Constituents of the essential oil from Tanacetum lingulatum (Boiss.) Bornm.,
J. Essent. Oil Res., 2003, 15, 2, 74-76, https://doi.org/10.1080/10412905.2003.9712069
. [all data]
Dudai, Larkov, et al., 2003
Dudai, N.; Larkov, O.; Chaimovitsh, D.; Lewinsohn, E.; Freiman, L.; Ravid, U.,
Essential oil compounds of Origanum dayi Post,
Flavour Fragr. J., 2003, 18, 4, 334-337, https://doi.org/10.1002/ffj.1237
. [all data]
Ghannadi and Zolfaghari, 2003
Ghannadi, A.; Zolfaghari, B.,
Compositional analysis of the essential oil of Lallemantia royleana (Benth. in Wall.) Benth. from Iran,
Flavour Fragr. J., 2003, 18, 3, 237-239, https://doi.org/10.1002/ffj.1215
. [all data]
Pitarokili, Tzakou, et al., 2003
Pitarokili, D.; Tzakou, O.; Loukis, A.; Harvala, C.,
Volatile metabolites from Salvia fruticosa as antifungal agents in soilborne pathogens,
J. Agric. Food Chem., 2003, 51, 11, 3294-3301, https://doi.org/10.1021/jf0211534
. [all data]
Bos, Koulman, et al., 2002
Bos, R.; Koulman, A.; Woerdenbag, H.J.; Quax, W.J.; Pras, N.,
Volatile components from Anthriscus sylvestris (L.) Hoffm.,
J. Chromatogr. A, 2002, 966, 1-2, 233-238, https://doi.org/10.1016/S0021-9673(02)00704-5
. [all data]
Koulman, 1999
Koulman, A.,
Podophyllotoxin: a study of biosynthesis, evolution, function, and use of podophyllotoxin and related lignans, University Library Groningen, Nederlands, 1999, 188, retrieved from http://www.ub.rug.nl/eldoc/dis/science/a.koulman/. [all data]
Kaul, Singh, et al., 1993
Kaul, V.K.; Singh, B.; Sood, R.P.,
Volatile Constituents of the Essential Oil of Tanacetum longifolium Wall.,
J. Essent. Oil Res., 1993, 5, 6, 597-601, https://doi.org/10.1080/10412905.1993.9698290
. [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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