Cedrane
- Formula: C15H26
- Molecular weight: 206.3669
- IUPAC Standard InChI: InChI=1S/C15H26/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h10-13H,5-9H2,1-4H3/t10?,11-,12+,13+,15+/m0/s1
- IUPAC Standard InChIKey: JJTQQGNEXQKQRF-RCVBVVPMSA-N
- CAS Registry Number: 13567-55-0
- 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: 8βH-Cedrane; 8αH-Cedrane; epi-cedrane; β-Cedrane; α-Cedrane
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Gas Chromatography
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
Kovats' RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Packed | SF-96 | 150. | 1463. | Maarse, 1975 | Chromosorb W-AW; Column length: 3.0 m |
| Packed | SF-96 | 150. | 1465. | Maarse, 1975 | Chromosorb W-AW; Column length: 3.0 m |
| Packed | SF-96 | 150. | 1455. | Maarse, 1975 | Chromosorb W-AW; Column length: 3.0 m |
| Packed | SF-96 | 150. | 1458. | Maarse, 1975 | Chromosorb W-AW; Column length: 3.0 m |
| Packed | SF-96 | 170. | 1479. | Andersen and Falcone, 1969 | |
| Packed | SF-96 | 170. | 1470. | Andersen and Falcone, 1969 |
Kovats' RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-5 | 1424. | Buchin, Salmon, et al., 2002 | 60. m/0.32 mm/1. μm, He, 40. C @ 5. min, 3. K/min, 230. C @ 2. min |
| Capillary | DB-5 | 1471. | Buchin, Salmon, et al., 2002 | 60. m/0.32 mm/1. μm, He, 40. C @ 5. min, 3. K/min, 230. C @ 2. min |
Kovats' RI, polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Packed | Carbowax 20M | 130. | 1625. | Maarse, 1975 | Chromosorb W-AW; Column length: 3.0 m |
| Packed | Carbowax 20M | 130. | 1627. | Maarse, 1975 | Chromosorb W-AW; Column length: 3.0 m |
| Packed | Carbowax 20M | 130. | 1617. | Maarse, 1975 | Chromosorb W-AW; Column length: 3.0 m |
| Packed | Carbowax 20M | 130. | 1617. | Maarse, 1975 | Chromosorb W-AW; Column length: 3.0 m |
| Packed | Carbowax 20M | 165. | 1662. | Andersen and Falcone, 1969 | |
| Packed | Carbowax 20M | 165. | 1651. | Andersen and Falcone, 1969 |
Van Den Dool and Kratz RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-5 | 1425. | Sati and Mathela, 2005 | 30. m/0.25 mm/0.26 μm, He, 3. K/min; Tstart: 60. C; Tend: 210. C |
| Capillary | HP-5 | 1435. | Isidorov, Krajewska, et al., 2004 | 30. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 40. C; Tend: 250. C |
| Capillary | RTX-5 | 1438. | Shellie, Marriott, et al., 2003 | 30. m/0.25 mm/0.25 μm, He, 45. C @ 6. min, 3. K/min; Tend: 250. C |
Van Den Dool and Kratz RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-5 | 1441. | Isidorov, Krajewska, et al., 2000 | 30. m/0.25 mm/0.25 μm; Program: 40C(1min) => 3C/min => 120C => 5C/min => 280C |
| Capillary | HP-5 | 1437. | Isidorov, Krajewska, et al., 2000 | 30. m/0.25 mm/0.25 μm; Program: 40C(1min) => 3C/min => 120C => 5C/min => 280C |
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-5 | 1436. | Letchamo, Ward, et al., 2004 | 30. m/0.25 mm/0.25 μm, He; Program: 60C(4min) => 6C/min => 240 => 10C/min => 280C |
Normal alkane RI, polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-Wax | 1633. | Giuseppe, Manuela, et al., 2005 | 30. m/0.25 mm/0.25 μm, He; Program: 35C(5min) => 2C/min => 173C(1min) => 15C/min => 210C(5min) |
References
Go To: Top, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Maarse, 1975
Maarse, H.,
Hydrogenolysis of terpenes in the injection port of a gas chromatograph. II. Sesquiterpenes,
J. Chromatogr., 1975, 106, 2, 369-384, https://doi.org/10.1016/S0021-9673(00)93846-9
. [all data]
Andersen and Falcone, 1969
Andersen, N.H.; Falcone, M.S.,
The identification of sesquiterpene hydrocarbons from gas-liquid chromatography retention data,
J. Chromatogr., 1969, 44, 52-59, https://doi.org/10.1016/S0021-9673(01)92497-5
. [all data]
Buchin, Salmon, et al., 2002
Buchin, S.; Salmon, J.-C.; Carnat, A.-P.; Berger, T.; Bugaud, C.; Bosset, J.O.,
Identification de composés monoterpéniques, sesquiterpéniques et benzéniques dans un lait d'alpage très riche en ces substances,
Mitt. Lebensmittelunters. Hyg., 2002, 93, 199-216. [all data]
Sati and Mathela, 2005
Sati, S.; Mathela, C.S.,
Essential oil composition of Valeriana hardwickii var. arnottiana from the Himalayas,
Flavour Fragr. J., 2005, 20, 3, 299-301, https://doi.org/10.1002/ffj.1415
. [all data]
Isidorov, Krajewska, et al., 2004
Isidorov, V.A.; Krajewska, U.; Vinogorova, V.T.; Vetchinnikova, L.V.; Fuksman, I.L.; Bal, K.,
Gas chromatographic analysis of essential oil from buds of different birch species with preliminary partition of components,
Biochem. Syst. Ecol., 2004, 32, 1, 1-13, https://doi.org/10.1016/S0305-1978(03)00175-3
. [all data]
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,
J. Essent. Oil Res., 2003, 15, 5, 305-312, https://doi.org/10.1080/10412905.2003.9698597
. [all data]
Isidorov, Krajewska, et al., 2000
Isidorov, V.; Krajewska, U.; Bal, K.; Jaroszynska, J.; Niesluchowska, A.; Fuksman, I.,
GC-MS identification of multicomponent organic compounds mixtures using extra column phase equilibrium,
Chem. Anal. (Warsaw), 2000, 45, 513-520. [all data]
Letchamo, Ward, et al., 2004
Letchamo, W.; Ward, W.; Heard, B.; Heard, D.,
Essential oil of Valeriana officinalis L. cultivars and their antimicrobial activity as influenced by harvesting time under commercial organic cultivation,
J. Agric. Food Chem., 2004, 52, 12, 3915-3919, https://doi.org/10.1021/jf0353990
. [all data]
Giuseppe, Manuela, et al., 2005
Giuseppe, Z.; Manuela, G.; Marta, B.; Vincenzo, G.,
Application of artificial neural network on mono- and sesquiterpenes compounds determined by headspace solid-phase microextraction-gas chromatography-mass spectrometry for the Piedmont ricotta cheese traceability,
J. Chromatogr. A, 2005, 1071, 1-2, 247-253, https://doi.org/10.1016/j.chroma.2004.11.083
. [all data]
Notes
Go To: Top, Gas Chromatography, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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