1H-3a,7-Methanoazulene, 2,3,4,7,8,8a-hexahydro-3,6,8,8-tetramethyl-, [3R-(3α,3aβ,7β,8aα)]-
- Formula: C15H24
- Molecular weight: 204.3511
- IUPAC Standard InChI: InChI=1S/C15H24/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h7,11-13H,5-6,8-9H2,1-4H3/t11-,12+,13+,15+/m0/s1
- IUPAC Standard InChIKey: IRAQOCYXUMOFCW-KYEXWDHISA-N
- CAS Registry Number: 469-61-4
- 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: Cedr-8-ene; α-Cedrene; (3R,3aS,7S,8aS)-3,6,8,8-Tetramethyl-2,3,4,7,8,8a-hexahydro-1H-3a,7-methanoazulene; (-)-α-Cedrene; [3R-(3α,3aβ,7β,8aα)]-2,3,4,7,8,8a-hexahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulene
- 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 | Optima-5 | DB-5 MS | DB-5 | HP-5 MS | DB-5 |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | Helium | Helium | Helium | Helium | Helium |
| 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. | 60. | 50. | 100. | 40. |
| Tend (C) | 246. | 270. | 250. | 220. | 250. |
| Heat rate (K/min) | 3. | 3. | 2. | 2. | 10. |
| Initial hold (min) | 1. | 1. | |||
| Final hold (min) | 3. | ||||
| I | 1415. | 1407. | 1412. | 1410. | 1412. |
| Reference | Al-Qudah, Muhaidat, et al., 2012 | Cui, Yang, et al., 2011 | Ho, Wang, et al., 2010 | Pripdeevech, Chumpolsri, et al., 2010 | Yang, Zhang, et al., 2010 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 | DB-5 | HP-5 | HP-5 | DB-5 |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | Helium | Helium | Nitrogen | N2 | Helium |
| 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. | 50. | 50. | 60. | 100. |
| Tend (C) | 220. | 250. | 280. | 220. | 300. |
| Heat rate (K/min) | 3. | 5. | 5. | 5. | 20. |
| Initial hold (min) | 2. | 1. | 10. | 2. | |
| Final hold (min) | 40. | 1. | 10. | ||
| I | 1409. | 1412. | 1436. | 1411. | 1409. |
| Reference | El-Massry, El-Ghorab, et al., 2009 | Ho, Wang, et al., 2009 | Bousaada, Ammar, et al., 2008 | Flamini, Tebano, et al., 2008 | Khokra, Prakash, et al., 2008 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | HP-5 | HP-5MS | HP-1 | HP-5 | HP-5 |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | Helium | He | Helium | He | N2 |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.32 | 0.25 | 0.25 | 0.32 | 0.25 |
| Tstart (C) | 60. | 60. | 70. | 60. | 50. |
| Tend (C) | 250. | 240. | 200. | 250. | 280. |
| Heat rate (K/min) | 5. | 3. | 10. | 5. | 9. |
| Initial hold (min) | 30. | 30. | 3. | ||
| Final hold (min) | 3. | ||||
| I | 1408. | 1413. | 1413. | 1408. | 1420. |
| Reference | Yassa and Akhani, 2008 | Argyropoulou, Daferera, et al., 2007 | Dongmo, Tatsadjieu, et al., 2007 | Yassa and Akhani, 2007 | Abdelwahed, Hayder, 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 | HP-5 | BP-1 | DB-1 | HP-5 |
| Column length (m) | 30. | 30. | 50. | 50. | 30. |
| Carrier gas | N2 | He | He | N2 | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.22 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 50. | 60. | 60. | 95. | 60. |
| Tend (C) | 280. | 246. | 220. | 240. | 220. |
| Heat rate (K/min) | 9. | 3. | 2. | 4. | 5. |
| Initial hold (min) | 3. | 10. | |||
| Final hold (min) | 3. | 20. | |||
| I | 1438. | 1410. | 1413. | 1397. | 1414. |
| Reference | Abdelwahed, Hayder, et al., 2006 | Coronel, Cerda-Garcia-Rojas, et al., 2006 | Lesueur, Ban, et al., 2006 | Pala-Paul J., Perez-Alonso M.J., et al., 2006 | Pintore G., Chessa M., 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 | Ultra-2 | DB-5 | HP-1 | DB-1 |
| Column length (m) | 30. | 50. | 30. | 50. | 30. |
| Carrier gas | Hydrogen | He | He | He | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.2 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.32 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 120. | 50. | 40. | 60. | 50. |
| Tend (C) | 180. | 270. | 260. | 250. | 265. |
| Heat rate (K/min) | 2. | 2. | 2. | 2. | 2.5 |
| Initial hold (min) | 5. | 60. | 1. | ||
| Final hold (min) | 20. | 20. | |||
| I | 1430. | 1434. | 1405. | 1389. | 1389. |
| Reference | Pripdeevech, Wongpornchai, et al., 2006 | Schlumpberger B.O., Clery R.A., et al., 2006 | Senatore, Landolfi, et al., 2006 | Fernandez, Lizzani-Cuvelier, et al., 2005 | Khanavi, Ghasemian, et al., 2005 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-1 | DB-1 | CP Sil 5 CB | CP Sil 5 CB | HP-5MS |
| Column length (m) | 30. | 50. | 30. | 30. | 30. |
| Carrier gas | He | N2 | 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) | 50. | 95. | 40. | 40. | 60. |
| Tend (C) | 265. | 240. | 220. | 220. | 280. |
| Heat rate (K/min) | 2.5 | 4. | 4. | 4. | 3. |
| Initial hold (min) | 1. | 1. | 1. | ||
| Final hold (min) | 30. | ||||
| I | 1390. | 1405. | 1412. | 1412. | 1408. |
| Reference | Khalighi-Sigaroodi, Hadijiakhoondi, et al., 2005 | Palá-Paúl, Pérez-Alonso, et al., 2005 | Rohloff and Bones, 2005 | Rohloff and Bones, 2005 | Slavkovska, Couladis, et al., 2005 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-1 | SPB-5 | HP-5 | DB-5 | HP-1 |
| Column length (m) | 60. | 60. | 25. | 30. | 30. |
| Carrier gas | N2 | He | H2 | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.32 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 1. | 0.52 | 0.25 | 0.25 |
| Tstart (C) | 70. | 60. | 40. | 60. | 70. |
| Tend (C) | 230. | 200. | 240. | 240. | 200. |
| Heat rate (K/min) | 2. | 4. | 4. | 4. | 10. |
| Initial hold (min) | 2. | ||||
| Final hold (min) | 20. | 30. | |||
| I | 1421. | 1409. | 1444. | 1411. | 1400. |
| Reference | Choi, 2004 | Gauvin, Ravaomanarivo, et al., 2004 | Simic, Sokovic, et al., 2004 | Cabanillas, Lopez, et al., 2003 | Fekam Boyom, Amvam Zollo, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-1 | HP-5MS | DB-5MS | DB-1 | DB-5 |
| Column length (m) | 30. | 30. | 30. | 50. | 30. |
| Carrier gas | N2 | He | He | N2 | 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) | 50. | 60. | 60. | 95. | 60. |
| Tend (C) | 200. | 280. | 240. | 240. | 240. |
| Heat rate (K/min) | 5. | 4. | 3. | 4. | 3. |
| Initial hold (min) | |||||
| Final hold (min) | |||||
| I | 1397. | 1409. | 1418. | 1394. | 1408. |
| Reference | Fekam Boyom, Ngouana, et al., 2003 | Ghasemi, Asghari, et al., 2003 | Maia, Taveira, et al., 2003 | Perez-Alonso, Velasco-Negueruela, et al., 2003 | da Silva, Luz, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 | HP-5 | HP-5 | DB-5 | DB-1 |
| Column length (m) | 30. | 60. | 60. | 30. | 50. |
| Carrier gas | He | He | N2 | ||
| 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. | 40. | 40. | 35. | 80. |
| Tend (C) | 240. | 250. | 250. | 280. | 225. |
| Heat rate (K/min) | 3. | 5. | 5. | 4. | 4. |
| Initial hold (min) | 15. | 15. | 2. | ||
| Final hold (min) | 15. | ||||
| I | 1410. | 1420. | 1420. | 1420. | 1394. |
| Reference | da Silva, Luz, et al., 2003 | Stashenko, Jaramillo, et al., 2003 | Stashenko, Jaramillo, et al., 2003 | Krauze-Baranowska, Mardarowicz, et al., 2002 | Palá-Paúl, Pérez-Alonso, et al., 2002 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 | DB-5 | HP-1 | OV-101 | DB-5 |
| Column length (m) | 30. | 30. | 25. | 50. | 30. |
| Carrier gas | He | He | H2 | N2 | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.2 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.17 | 0.25 | |
| Tstart (C) | 60. | 60. | 40. | 80. | 60. |
| Tend (C) | 300. | 240. | 260. | 200. | 240. |
| Heat rate (K/min) | 2. | 3. | 3. | 1. | 3. |
| Initial hold (min) | 5. | ||||
| Final hold (min) | 20. | ||||
| I | 1389. | 1409. | 1393. | 1433. | 1410. |
| Reference | Ruberto, Biondi, et al., 2002 | Tellez M., Estell R., et al., 2001 | Lopes, Koketsu, et al., 1999 | Menon, Chacko, et al., 1999 | Tellez, Canel, et al., 1999 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | CP Sil 5 CB | DB-5 | DB-5 | DB-1 | HP-101 |
| Column length (m) | 25. | 30. | 30. | 60. | 50. |
| Carrier gas | N2 | He | Helium | He | H2 |
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.25 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.3 |
| Tstart (C) | 50. | 65. | 60. | 50. | 65. |
| Tend (C) | 290. | 300. | 240. | 250. | 300. |
| Heat rate (K/min) | 4. | 4. | 3. | 2.5 | 2. |
| Initial hold (min) | 2. | 5. | 5. | ||
| Final hold (min) | |||||
| I | 1398. | 1420. | 1411. | 1435. | 1407. |
| Reference | Bos, Woerdenbag, et al., 1997 | Elias, Simoneit, et al., 1997 | Tellez, Estell, et al., 1997 | Stashenko, Puertas, et al., 1996 | Demarne and van der Walt, 1993 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-1 | SE-30 | SE-30 | SE-30 | SE-30+Igepal |
| Column length (m) | 60. | 30. | 30. | 50. | 100. |
| Carrier gas | He | ||||
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.5 | 0.25 | ||
| Phase thickness (μm) | |||||
| Tstart (C) | 50. | 50. | 50. | 40. | 70. |
| Tend (C) | 230. | 240. | 240. | 170. | 170. |
| Heat rate (K/min) | 4. | 4. | 4. | 3. | 1. |
| Initial hold (min) | 2. | 2. | 3. | ||
| Final hold (min) | 10. | 10. | 10. | ||
| I | 1409. | 1411. | 1411. | 1434. | 1435. |
| Reference | Binder, Benson, et al., 1990 | Ramaswami, Briscese, et al., 1988 | Ramaswami, Briscese, et al., 1986 | Heydanek and McGorrin, 1981 | Shibamoto and Jennings, 1977 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary |
|---|---|
| Active phase | SE-30+Igepal |
| Column length (m) | 100. |
| Carrier gas | |
| Substrate | |
| Column diameter (mm) | 0.25 |
| Phase thickness (μm) | |
| Tstart (C) | 70. |
| Tend (C) | 170. |
| Heat rate (K/min) | 1. |
| Initial hold (min) | |
| Final hold (min) | |
| I | 1436. |
| Reference | Shibamoto and Jennings, 1977 |
| Comment | 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.
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Notes
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