Cubenene

Formula: C₁₅H₂₄
Molecular weight: 204.3511
IUPAC Standard InChI: InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-10,13,15H,5-8H2,1-4H3/t13-,15?/m0/s1
IUPAC Standard InChIKey: FUCYIEXQVQJBKY-CFMCSPIPSA-N
Chemical structure:
This structure is also available as a 2d Mol file
Stereoisomers:
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Gas Chromatography

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Column type	Active phase	I	Reference	Comment
Capillary	Carbowax 20M	1754.	Randriamiharisoa and Gaydou, 1987	He, 2. K/min; Column length: 50. m; Column diameter: 0.3 mm; T_start: 70. C; T_end: 210. C

Column type	Active phase	I	Reference	Comment
Capillary	CP Sil 5 CB	1527.	Pino, Marbot, et al., 2002	25. m/0.25 mm/0.25 μm, N2, 60. C @ 6. min, 4. K/min; T_end: 280. C
Capillary	CP Sil 5 CB	1526.	Pino, Marbot, et al., 2002, 2	50. m/0.32 mm/0.4 μm, He, 60. C @ 10. min, 3. K/min, 280. C @ 60. min
Capillary	CP Sil 5 CB	1531.	Pino, Marbot, et al., 2001	50. m/0.32 mm/0.4 μm, He, 60. C @ 10. min, 3. K/min, 280. C @ 60. min
Capillary	OV-1	1509.	Bicchi, Fresia, et al., 1997	25. m/0.25 mm/0.3 μm, H2, 50. C @ 1. min, 3. K/min, 200. C @ 20. min

Column type	Active phase	I	Reference	Comment
Capillary	AT-Wax	1761.	Pino, Marbot, et al., 2002, 2	60. m/0.32 mm/0.25 μm, He, 65. C @ 10. min, 2. K/min, 250. C @ 60. min
Capillary	AT-Wax	1761.	Pino, Marbot, et al., 2001	60. m/0.32 mm/0.25 μm, He, 65. C @ 10. min, 2. K/min, 250. C @ 60. min
Capillary	Carbowax 20M	1754.	Bicchi, Fresia, et al., 1997	25. m/0.25 mm/0.3 μm, 50. C @ 1. min, 3. K/min, 200. C @ 20. min

Column type	Active phase	I	Reference	Comment
Capillary	DB-5	1522.	Marongiu, Porcedda, et al., 2003	30. m/0.25 mm/0.25 μm, He, 3. K/min, 280. C @ 30. min; T_start: 60. C
Capillary	OV-101	1511.	Camciuc, Bessière, et al., 1998	50. m/0.22 mm/1. μm, He, 100. C @ 1. min, 1. K/min; T_end: 220. C
Capillary	HP-1	1520.	Thanh, Dung, et al., 1996	25. m/0.32 mm/0.25 μm, Helium, 60. C @ 2. min, 4. K/min, 220. C @ 20. min

Column type	Active phase	I	Reference	Comment
Capillary	Carbowax 20M	1754.	Gaydou, Faure, et al., 1989	50. m/0.32 mm/0.15 μm, H2, 2. K/min; T_start: 70. C; T_end: 210. C

Column type	Active phase	I	Reference	Comment
Capillary	HP-Innowax FSC	1798.	Sezik E., Kocakulak E., et al., 2005	60. m/0.25 mm/0.25 μm, He; Program: 60C(10min) => 4C/min => 220C(10min) => 1C/min => 240C

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Randriamiharisoa and Gaydou, 1987
Randriamiharisoa, R.P.; Gaydou, E.M., Composition of Palmarosa (Cymbopogon martinii) essential oil from Madagascar, J. Agric. Food Chem., 1987, 35, 1, 62-66, https://doi.org/10.1021/jf00073a015 . [all data]

Pino, Marbot, et al., 2002
Pino, J.A.; Marbot, R.; Quert, R.; García, H., Study of essential oils of Eucalyptus resinifera Smith, E. tereticornis Smith and Corymbia maculata (Hook.) K.D. Hill L.A.S. Johnson, grown in Cuba, Flavour Fragr. J., 2002, 17, 1, 1-4, https://doi.org/10.1002/ffj.1026 . [all data]

Pino, Marbot, et al., 2002, 2
Pino, J.A.; Marbot, R.; Vázquez, C., Characterization of volatile in Cosa Rican Guava [Psidium friedrichsthalianum (Berg) Niedenzu] fruit, J. Agric. Food Chem., 2002, 50, 21, 6023-6026, https://doi.org/10.1021/jf011456i . [all data]

Pino, Marbot, et al., 2001
Pino, J.A.; Marbot, R.; Vázquez, C., Characterization of volatiles in strawberry guava (Psidium cattleianum Sabine) fruit, J. Agric. Food Chem., 2001, 49, 12, 5883-5887, https://doi.org/10.1021/jf010414r . [all data]

Bicchi, Fresia, et al., 1997
Bicchi, C.; Fresia, M.; Rubiolo, P.; Monti, D.; Franz, C.; Goehler, I., Constituents of Tagetes lucida Cav. ssp. lucida essential oil, Flavour Fragr. J., 1997, 12, 1, 47-52, https://doi.org/10.1002/(SICI)1099-1026(199701)12:1<47::AID-FFJ610>3.0.CO;2-7 . [all data]

Marongiu, Porcedda, et al., 2003
Marongiu, B.; Porcedda, S.; Caredda, A.; de Gioannis, B.; Vargiu, L.; la Colla, P., Extraction of Juniperus oxycedrus ssp. Oxycedrus essential oil by supercritical carbon dioxide: influence of some process parameters and biological activity, Flavour Fragr. J., 2003, 18, 5, 390-397, https://doi.org/10.1002/ffj.1224 . [all data]

Camciuc, Bessière, et al., 1998
Camciuc, M.; Bessière, J.M.; Vilarem, G.; Gaset, A., Volatile components in okra seed coat, Phytochemistry, 1998, 48, 2, 311-315, https://doi.org/10.1016/S0031-9422(97)01127-8 . [all data]

Thanh, Dung, et al., 1996
Thanh, L.; Dung, N.X.; Bighetti, A.; Casanova, J.; Leclercq, P.A., Combination of cCapillary GC, GC/MS and 13C-NMR for the Characterization of the Rhizome Oil of Piper betle L. (Piperaceae) from Vietnam, Spectroscopy, 1996, 13, 2, 131-136, https://doi.org/10.1155/1997/397354 . [all data]

Gaydou, Faure, et al., 1989
Gaydou, E.M.; Faure, R.; Bianchini, J.-P.; Lamaty, G.; Rakotonirainy, O.; Randriamiharisoa, R., Sesquiterpene composition of basil oil. Assignment of the ¹H and ¹³C NMR spectra of β-elemene with two-dimensional NMR, J. Agric. Food Chem., 1989, 37, 4, 1032-1037, https://doi.org/10.1021/jf00088a048 . [all data]

Sezik E., Kocakulak E., et al., 2005
Sezik E.; Kocakulak E.; Baser K.H.C.; Ozek T., Composition of the essential oils of Juniperus oxycedrus subsp macrocarpa from Turkey, Chem. Nat. Compd. (Engl. Transl.), 2005, 41, 3, 352-354, https://doi.org/10.1007/s10600-005-0149-0 . [all data]

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Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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