Alloaromadendrene
- Formula: C15H24
- Molecular weight: 204.3511
- IUPAC Standard InChIKey: ITYNGVSTWVVPIC-OOAQSJESSA-N
- CAS Registry Number: 25246-27-9
- 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: 1H-Cycloprop[e]azulene, decahydro-1,1,7-trimethyl-4-methylene-, [1aR-(1aα,4aβ,7α,7aβ,7bα)]-; 1H-Cycloprop[e]azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR,4aS,7R,7aR,7bS)-(-)-; (-)-Alloaromadendrene; L-Alloaromadendrene; Alloaromadendren; 1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulene-, [1aR-(1aα,4aβ,7α,7aβ,7bα)]-; Aromadendrene, allo-; (1aR,4aS,7R,7aR,7bS)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulene; Alloaromadedrene; allo-aromandendrene
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Options:
Van Den Dool and Kratz RI, 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 | BP-20 | HP-20M | RTX-Wax | RTX-Wax | DB-Wax |
Column length (m) | 50. | 50. | 60. | 60. | 30. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.22 | 0.2 | 0.22 | 0.22 | 0.25 |
Phase thickness (μm) | 0.25 | 0.2 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 60. | 70. | 60. | 60. | 40. |
Tend (C) | 220. | 180. | 230. | 230. | 250. |
Heat rate (K/min) | 2. | 4. | 2. | 2. | 3. |
Initial hold (min) | 4. | 5. | |||
Final hold (min) | 20. | 10. | 35. | 35. | 10. |
I | 1638. | 1606. | 1631. | 1631. | 1646. |
Reference | Lesueur, de Rocca Serra, et al., 2007 | Maksimovic, Vidic, et al., 2007 | Paolini J., Costa J., et al., 2007 | Paolini, Muselli, et al., 2007 | Aromdee and Sriubolmas, 2006 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | RTX-Wax | BP-20 | Supelcowax-10 | Supelcowax-10 | PEG |
Column length (m) | 60. | 50. | 30. | 30. | 30. |
Carrier gas | He | He | He | He | N2 |
Substrate | |||||
Column diameter (mm) | 0.22 | 0.22 | 0.2 | 0.2 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.2 | 0.2 | 0.25 |
Tstart (C) | 60. | 60. | 70. | 70. | 50. |
Tend (C) | 230. | 220. | 220. | 220. | 220. |
Heat rate (K/min) | 2. | 2. | 3. | 3. | 2. |
Initial hold (min) | 3. | ||||
Final hold (min) | 45. | 20. | 15. | 15. | 15. |
I | 1630. | 1642. | 1636. | 1639. | 1685. |
Reference | Cavalli, Tomi, et al., 2006 | Duquesnoy, Dinh, et al., 2006 | Pinto, Pina-Vaz, et al., 2006 | Salgueiro L.R., Pinto E., et al., 2006 | Dob, Berramdane, et al., 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | RTX-Wax | DB-Wax | Supelcowax-10 | HP-Wax | HP-Wax |
Column length (m) | 60. | 30. | 30. | 30. | 30. |
Carrier gas | He | N2 | He | N2 | N2 |
Substrate | |||||
Column diameter (mm) | 0.22 | 0.25 | 0.2 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.2 | 0.25 | 0.25 |
Tstart (C) | 60. | 60. | 70. | 60. | 60. |
Tend (C) | 230. | 220. | 220. | 240. | 240. |
Heat rate (K/min) | 2. | 5. | 3. | 3. | 3. |
Initial hold (min) | 10. | ||||
Final hold (min) | 35. | 15. | |||
I | 1631. | 1681. | 1637. | 1640. | 1640. |
Reference | Paolini, Costa, et al., 2005 | Bertoli, Menichini, et al., 2004 | Cavaleiro, Salgueiro, et al., 2004 | Flamini, Cioni, et al., 2004 | Flamini, Cioni, et al., 2004 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | BP-20 | RTX-Wax | HP-20M | RTX-Wax | HP-Innowax |
Column length (m) | 50. | 60. | 50. | 30. | 30. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.22 | 0.22 | 0.2 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.2 | 0.25 | 0.5 |
Tstart (C) | 60. | 60. | 70. | 45. | 60. |
Tend (C) | 230. | 230. | 180. | 250. | 260. |
Heat rate (K/min) | 2. | 2. | 4. | 3. | 3. |
Initial hold (min) | 4. | 6. | |||
Final hold (min) | 35. | 45. | 10. | ||
I | 1635. | 1637. | 1627. | 1618. | 1637. |
Reference | Bianchini, Tomi, et al., 2003 | Cavalli, Tomi, et al., 2003 | Jerkovic, Mastelic, et al., 2003 | Shellie, Marriott, et al., 2003 | Skaltsa, Demetzos, et al., 2003 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | HP-Innowax | Innowax | AT-Wax | HP-Innowax | HP-Innowax |
Column length (m) | 30. | 30. | 60. | 30. | 30. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.25 | 0.25 |
Phase thickness (μm) | 0.5 | 0.5 | 0.25 | 0.50 | 0.50 |
Tstart (C) | 60. | 60. | 65. | 60. | 60. |
Tend (C) | 260. | 260. | 250. | 260. | 260. |
Heat rate (K/min) | 3. | 3. | 2. | 3. | 3. |
Initial hold (min) | 10. | ||||
Final hold (min) | 10. | 60. | 10. | ||
I | 1660. | 1660. | 1627. | 1660. | 1660. |
Reference | Tzakou, Couladis, et al., 2003 | Couladis, Chinou, et al., 2002 | Pino, Marbot, et al., 2002 | Couladis, Baziou, et al., 2001 | Couladis, Tzakou, et al., 2001 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-Wax | DB-Wax | DB-Wax | CP-Wax 52CB | HP-20M |
Column length (m) | 60. | 60. | 60. | 25. | 50. |
Carrier gas | He | He | He | ||
Substrate | |||||
Column diameter (mm) | 0.50 | 0.53 | 0.53 | 0.25 | 0.2 |
Phase thickness (μm) | 1.0 | 1.0 | 1.0 | 0.15 | 0.2 |
Tstart (C) | 60. | 50. | 50. | 40. | 70. |
Tend (C) | 225. | 220. | 220. | 220. | 180. |
Heat rate (K/min) | 3. | 3. | 3. | 3. | 4. |
Initial hold (min) | 5. | 4. | |||
Final hold (min) | 10. | ||||
I | 1642. | 1642. | 1642. | 1662. | 1612. |
Reference | Brophy, Goldsack, et al., 2000 | Brophy, Goldsack, et al., 2000, 2 | Brophy, Goldsack, et al., 2000, 3 | Chagonda, Makanda, et al., 2000 | Milos and Radonic, 2000 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-Wax | DB-Wax | Innowax | Carbowax 20M | DB-Wax |
Column length (m) | 60. | 60. | 60. | 25. | 60. |
Carrier gas | He | He | He | H2 | He |
Substrate | |||||
Column diameter (mm) | 0.53 | 0.53 | 0.25 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.3 | |||
Tstart (C) | 50. | 50. | 50. | 50. | 35. |
Tend (C) | 220. | 220. | 180. | 200. | 220. |
Heat rate (K/min) | 3. | 3. | 2.5 | 3. | 3. |
Initial hold (min) | 5. | 1. | |||
Final hold (min) | 20. | ||||
I | 1642. | 1642. | 1662. | 1648. | 1647. |
Reference | Brophy, Goldsack, et al., 1999 | Brophy, Goldsack, et al., 1999, 2 | Stashenko, Cervantes, et al., 1999 | Bicchi, Rubiolo, et al., 1998 | Brophy, Forster, et al., 1998 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | SP-1000 | DB-Wax | DB-Wax | DB-Wax | SP-1000 |
Column length (m) | 85. | 60. | 60. | 60. | 85. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.5 | 0.32 | 0.32 | 0.32 | 0.5 |
Phase thickness (μm) | |||||
Tstart (C) | 60. | 65. | 35. | 65. | 65. |
Tend (C) | 225. | 225. | 220. | 225. | 225. |
Heat rate (K/min) | 3. | 3. | 3. | 3. | 3. |
Initial hold (min) | |||||
Final hold (min) | |||||
I | 1642. | 1642. | 1642. | 1642. | 1642. |
Reference | Brophy, Forster, et al., 1998, 2 | Brophy, Goldsack, et al., 1998 | Brophy, Goldsack, et al., 1998, 2 | Brophy, Goldsack, et al., 1997 | Brophy, Goldsack, et al., 1997, 2 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | BP-20 | BP-20 | DB-Wax | Carbowax 20M | DB-Wax |
Column length (m) | 50. | 50. | 60. | 50. | 60. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.22 | 0.22 | 0.32 | 0.2 | 0.20 |
Phase thickness (μm) | 0.25 | 0.25 | 0.5 | 0.2 | 0.20 |
Tstart (C) | 60. | 60. | 50. | 30. | 70. |
Tend (C) | 230. | 230. | 225. | 170. | 180. |
Heat rate (K/min) | 2. | 2. | 2. | 4. | 2. |
Initial hold (min) | 2. | 5. | |||
Final hold (min) | 35. | 35. | 20. | 20. | |
I | 1636. | 1633. | 1663. | 1656. | 1662. |
Reference | Mariotti, Costa, et al., 1997 | Mariotti, Tomi, et al., 1997 | Sagrero-Nieves, Bartley, et al., 1997 | Píry, Príbela, et al., 1995 | Stashenko, Wiame, et al., 1995 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary |
---|---|---|
Active phase | HP-20M | DB-Wax |
Column length (m) | 50. | 30. |
Carrier gas | He | He |
Substrate | ||
Column diameter (mm) | 0.25 | 0.32 |
Phase thickness (μm) | 0.5 | |
Tstart (C) | 60. | 40. |
Tend (C) | 190. | 220. |
Heat rate (K/min) | 3. | 3. |
Initial hold (min) | ||
Final hold (min) | ||
I | 1639. | 1643. |
Reference | Chung, Eiserich, et al., 1993 | Le Quere and Latrasse, 1990 |
Comment | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz RI, 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.
Lesueur, de Rocca Serra, et al., 2007
Lesueur, D.; de Rocca Serra, D.; Bighelli, A.; Hoi, T.M.; Ban, N.K.; Thai, T.H.; Casanova, J.,
Chemical composition and antibacterial activity of the essential oil of Michelia foveolata Merryll ex Dandy from Vietnam,
Flavour Fragr. J., 2007, 22, 4, 317-321, https://doi.org/10.1002/ffj.1799
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Maksimovic, Vidic, et al., 2007
Maksimovic, M.; Vidic, D.; Milos, M.; Solic, M.E.; Abadzic, S.; Siljak-Yakovlev, S.,
Effect of the environmental conditions on essential oil profile in two Dinaric Salvia species: S. brachyodon Vandas and S. officinalis L.,
Biochem. Syst. Ecol., 2007, 35, 8, 473-478, https://doi.org/10.1016/j.bse.2007.02.005
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Paolini J., Costa J., et al., 2007
Paolini J.; Costa J.; Bernardini A.F.,
Analysis of the essential oil from the roots of Eupatorium cannabinum subsp corsicum (L.) by GC, GC-MS and C-13-NMR,
Phytochem. Anal., 2007, 18, 3, 235-244, https://doi.org/10.1002/pca.977
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Paolini, Muselli, et al., 2007
Paolini, J.; Muselli, A.; Bernardini, A.-F.; Bighelli, A.; Casanova, J.; Costa, J.,
Thymol derivatives from essential oil of Doronicum corsicum L.,
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Aromdee and Sriubolmas, 2006
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Essential oil of the flowers of Azadirachta indica (Meliaceae),
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Cavalli, Tomi, et al., 2006
Cavalli, J.-F.; Tomi, F.; Bernardini, A.-F.; Casanova, J.,
Chemical variability of the essential oil of Helichrysum faradifani Sc. Ell. from Madagascar,
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Composition of a Pyrolytic oil from Cupressus funebris Endl. of Vietnamese origin,
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Pinto, Pina-Vaz, et al., 2006
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Antifuncal activity of the essential oil Thymus pulegioides on Candida, Aspergillus and dermatophyte species,
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Antifungal activity of the essential oil of Thymus capitellatus against Candida, Aspergillus and dermatophyte strains,
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Chemical composition of essential oil of Pinus halepensis Miller growing in Algeria,
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Bianchini, A.; Tomi, P.; Bernardini, A.F.; Morelli, I.; Flamini, G.; Cioni, P.L.; Usai, M.; Marchetti, M.,
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Cavalli, Tomi, et al., 2003
Cavalli, J.-F.; Tomi, F.; Bernardini, A.-F.; Casanova, J.,
Composition and chemical variability of the bark oil of Cedrelopsis grevei H. Baillon from Madagascar,
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Jerkovic, Mastelic, et al., 2003
Jerkovic, I.; Mastelic, J.; Milos, M.; Juteau, F.; Masotti, V.; Viano, J.,
Chemical variability of Artemisia vulgaris L. essential oils originated from the Mediterranean area of France and Croatia,
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Shellie, Marriott, et al., 2003
Shellie, R.; Marriott, P.; Zappia, G.; Mondello, L.; Dugo, G.,
Interactive use of linear retention indices on polar and apolar columns with an MS-Library for reliable characterization of Australian tea tree and other Melaleuca sp. oils,
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Skaltsa, Demetzos, et al., 2003
Skaltsa, H.D.; Demetzos, C.; Lazari, D.; Sokovic, M.,
Essential oil analysis and antimicrobial activity of eight Stachys species from Greece,
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Tzakou, Couladis, et al., 2003
Tzakou, O.; Couladis, M.; Slavkovska, V.; Mimica-Dukic, N.; Jancic, R.,
The essential oil composition of Salvia brachyodon Vandas,
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Couladis, Chinou, et al., 2002
Couladis, M.; Chinou, I.B.; Tzakou, O.; Loukis, A.,
Composition and antimicrobial activity of the essential oil of Ballota pseudodictamnus L. Bentham,
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Pino, Marbot, et al., 2002
Pino, J.A.; Marbot, R.; Vázquez, C.,
Characterization of volatile in Cosa Rican Guava [Psidium friedrichsthalianum (Berg) Niedenzu] fruit,
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Couladis, Baziou, et al., 2001
Couladis, M.; Baziou, P.; Petrakis, P.V.; Harvala, C.,
Essential oil composition of Hypericum perfoliatum L. growing in different locations in Greece,
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Couladis, Tzakou, et al., 2001
Couladis, M.; Tzakou, O.; Stojanovic, D.; Mimica-Dukic, N.; Jancic, R.,
The essential oil composition of Salvia argentea L.,
Flavour Fragr. J., 2001, 16, 3, 227-229, https://doi.org/10.1002/ffj.989
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Brophy, Goldsack, et al., 2000
Brophy, J.J.; Goldsack, R.J.; Forster, P.I.,
Essential oils of the genus Lophostemon (Myrtaceae),
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Brophy, Goldsack, et al., 2000, 2
Brophy, J.; Goldsack, R.J.; Bean, A.R.; Forster, P.I.; Lepschi, B.J.,
Leaf essential oils of the genus Leptospermum (Myrtaceae) in eastern Australia. Part 6. Leptospermum polygalifolium and allies,
Flavour Fragr. J., 2000, 15, 4, 271-277, https://doi.org/10.1002/1099-1026(200007/08)15:4<271::AID-FFJ910>3.0.CO;2-E
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Brophy, Goldsack, et al., 2000, 3
Brophy, J.J.; Goldsack, R.J.; Punruckvong, A.; Bean, A.R.; Forster, P.I.; Lepschi, B.J.; Doran, J.C.; Rozefelds, A.C.,
Leaf essential oils of the genus Leptospermum (Myrtaceae) in eastern Australia. Part 7. Leptospermum petersonii, L. liversidgei and allies,
Flavour Fragr. J., 2000, 15, 5, 342-351, https://doi.org/10.1002/1099-1026(200009/10)15:5<342::AID-FFJ924>3.0.CO;2-V
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Chagonda, Makanda, et al., 2000
Chagonda, L.S.; Makanda, C.D.; Chalchat, J.-C.,
The essential oils of Ocimum canum Sims (basilic camphor) and Ocimum urticifolia Roth from Zimbabwe,
Flavour Fragr. J., 2000, 15, 1, 23-26, https://doi.org/10.1002/(SICI)1099-1026(200001/02)15:1<23::AID-FFJ866>3.0.CO;2-W
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Milos and Radonic, 2000
Milos, M.; Radonic, A.,
Gas chromatography mass spectral analysis of free and glycosidically bound volatile compounds from Juniperus oxycedrus L. growing wild in Croatia,
Food Chem., 2000, 68, 3, 333-338, https://doi.org/10.1016/S0308-8146(99)00192-2
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Brophy, Goldsack, et al., 1999
Brophy, J.J.; Goldsack, R.J.; Punruckvong, A.; Forster, P.I.,
The leaf essential oils of Pilidiostigma (Myrtaceae),
Flavour Fragr. J., 1999, 14, 2, 143-146, https://doi.org/10.1002/(SICI)1099-1026(199903/04)14:2<143::AID-FFJ798>3.0.CO;2-P
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Brophy, Goldsack, et al., 1999, 2
Brophy, J.J.; Goldsack, R.J.; Bean, A.R.; Forster, P.I.; Lepschi, B.J.,
Leaf essential oils of the genus Leptospermum (Myrtaceae) in eastern Australia. Part 5. Leptospermum continentale and allies,
Flavour Fragr. J., 1999, 14, 2, 98-104, https://doi.org/10.1002/(SICI)1099-1026(199903/04)14:2<98::AID-FFJ797>3.0.CO;2-V
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Stashenko, Cervantes, et al., 1999
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Notes
Go To: Top, Van Den Dool and Kratz RI, polar column, temperature ramp, References
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