Humulene epoxide
- Formula: C15H24O
- Molecular weight: 220.3505
- IUPAC Standard InChIKey: RKQDKXOBRXTSFS-PIHCAMFYSA-N
- Chemical structure:
This structure is also available as a 2d Mol file - Species with the same structure:
- Stereoisomers:
- Other names: Humulene 6,7-epoxide; Humulene oxide I; α-humulene oxide; α-humulene epoxide I
- 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 | DB-5 | DB-5 | HP-1 | DB-5 |
Column length (m) | 60. | 30. | 30. | 50. | 30. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.22 | 0.25 | 0.25 | 0.2 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.33 | 0.25 |
Tstart (C) | 60. | 60. | 60. | 60. | 60. |
Tend (C) | 230. | 300. | 300. | 250. | 300. |
Heat rate (K/min) | 2. | 3. | 3. | 2. | 3. |
Initial hold (min) | 3. | ||||
Final hold (min) | 35. | 60. | |||
I | 1594. | 1599. | 1594. | 1586. | 1590. |
Reference | Paolini, Tomi, et al., 2008 | Limberger, Scopel, et al., 2007 | Apel, Sobral, et al., 2006 | Fernandez, Pintaric, et al., 2006 | Ferraz, Limberger, et al., 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5 | HP-5 | DB-5 | DB-5 | PE-5 |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | He | He | He | He | H2 |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 60. | 70. | 60. | 60. | 60. |
Tend (C) | 230. | 240. | 300. | 300. | 230. |
Heat rate (K/min) | 3. | 5. | 3. | 3. | 5. |
Initial hold (min) | 2. | ||||
Final hold (min) | 4. | ||||
I | 1589. | 1601. | 1597. | 1597. | 1610. |
Reference | Limberger, Sobral, et al., 2005 | Oyedeji, Yani, et al., 2005 | Simoes-Pires C.A., Debenedetti S., et al., 2005 | Simoes-Pires C.A., Debenedetti S., et al., 2005 | Singh, Raina, et al., 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | CP Sil 8 CB | HP-5 MS | DB-5 | DB-5 | RSL-200 |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | He | Helium | He | H2 | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | |
Tstart (C) | 60. | 60. | 60. | 60. | 40. |
Tend (C) | 290. | 240. | 300. | 300. | 280. |
Heat rate (K/min) | 3. | 3. | 3. | 3. | 6. |
Initial hold (min) | 5. | 5. | |||
Final hold (min) | 5. | ||||
I | 1596. | 1608. | 1596. | 1591. | 1594. |
Reference | Suárez, Vásquez, et al., 2005 | Urdampilleta, Amat, et al., 2005 | Limberger, Sobral, et al., 2004 | Suyenaga, Apel, et al., 2004 | Jirovetz, Buchbauer, 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 | PTE-5 | DB-5 | DB-5MS | CP Sil 5 CB |
Column length (m) | 30. | 60. | 30. | 30. | 25. |
Carrier gas | He | H2 | He | He | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.32 | 0.25 | 0.32 | 0.25 |
Phase thickness (μm) | 0.25 | 0.30 | 0.25 | 0.25 | 0.15 |
Tstart (C) | 60. | 60. | 60. | 40. | 50. |
Tend (C) | 250. | 285. | 250. | 280. | 230. |
Heat rate (K/min) | 3. | 4.3 | 3. | 4. | 3. |
Initial hold (min) | |||||
Final hold (min) | 5. | ||||
I | 1598. | 1606. | 1589. | 1623. | 1608. |
Reference | Limberger, Simões-Pires, et al., 2003 | Gudzic, Djokovic, et al., 2002 | Limberger, Simões-Pires, et al., 2002 | Phutdhawong, Korth, et al., 2002 | Asekun and Ekundayo, 2000 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|
Active phase | OV-101 | OV-101 | HP-1 | DB-1 |
Column length (m) | 25. | 25. | 30. | 10. |
Carrier gas | N2 | H2 | ||
Substrate | ||||
Column diameter (mm) | 0.32 | 0.32 | 0.53 | 0.25 |
Phase thickness (μm) | 0.88 | 0.25 | ||
Tstart (C) | 50. | 50. | 60. | 50. |
Tend (C) | 200. | 200. | 300. | 250. |
Heat rate (K/min) | 5. | 5. | 8. | 5. |
Initial hold (min) | ||||
Final hold (min) | 15. | |||
I | 1602. | 1593. | 1583. | 1592. |
Reference | Kuiate, Zollo, et al., 1999 | Zollo, Biyiti, et al., 1998 | Malizia, Molli, et al., 1996 | Perry, Baxter, et al., 1986 |
Comment | MSDC-RI | 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.
Paolini, Tomi, et al., 2008
Paolini, J.; Tomi, P.; Bernardini, A.-F.; Bradesi, P.; Casanova, J.; Kaloustian, J.,
Detailed analysis of the essential oil from Cistus albidus L. by combination of GC/RI, GC/MS and 13C-NMR spectroscopy,
N.Z. J. Agric. Res., 2008, 22, 14, 1270-1278. [all data]
Limberger, Scopel, et al., 2007
Limberger, R.P.; Scopel, M.; Sobral, M.; Henriques, A.T.,
Comparative analysis of volatiles from Drimys brasiliensis Miers and D. angustifolia Miers (Winteraceae) from Southern Brazil,
Biochem. Syst. Ecol., 2007, 35, 3, 130-137, https://doi.org/10.1016/j.bse.2006.09.007
. [all data]
Apel, Sobral, et al., 2006
Apel, M.A.; Sobral, M.; Zuanazzi, J.A.S.; Henriques, A.T.,
Essential oil composition of four Plinia species (Myrtaceae),
Flavour Fragr. J., 2006, 21, 3, 565-567, https://doi.org/10.1002/ffj.1638
. [all data]
Fernandez, Pintaric, et al., 2006
Fernandez, X.; Pintaric, C.; Lizzani-Cuvelier, L.; Loiseau, A.-M.; Morello, A.; Pellerin, P.,
Chemical composition of absolute and supercritical carbon dioxide extract of Aframomum melegueta,
Flavour Fragr. J., 2006, 21, 1, 162-165, https://doi.org/10.1002/ffj.1554
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Ferraz, Limberger, et al., 2005
Ferraz, A.B.F.; Limberger, R.P.; Bordignon, S.A.L.; von Poser, G.L.; Henriques, A.T.,
Essential oil composition of six Hypericum species from southern Brazil,
Flavour Fragr. J., 2005, 20, 3, 335-339, https://doi.org/10.1002/ffj.1435
. [all data]
Limberger, Sobral, et al., 2005
Limberger, R.P.; Sobral, M.; Henriques, A.T.,
Intraspecific volatile oil variation in Myrceugenia cucullata (Myrtaceae),
Biochem. Syst. Ecol., 2005, 33, 3, 287-293, https://doi.org/10.1016/j.bse.2004.10.002
. [all data]
Oyedeji, Yani, et al., 2005
Oyedeji, O.A.; Yani, V.V.; Afolayan, A.J.,
Chemical composition of the essential oil from Arctotis arctotoides (L.F.) O. Hoffm. (syn. Vendium arctotoides Less.),
Flavour Fragr. J., 2005, 20, 2, 232-234, https://doi.org/10.1002/ffj.1437
. [all data]
Simoes-Pires C.A., Debenedetti S., et al., 2005
Simoes-Pires C.A.; Debenedetti S.; Spegazzini E.; Mentz L.A.; Matzenbacher N.I.; Limberger R.P.; Henriques A.T.,
Investigation of the essential oil from eight species of Baccharis belonging to sect. Caulopterae (Asteraceae, Astereae): a taxonomic approach,
Plant Systematics and Evolution, 2005, 253, 1-4, 23-32, https://doi.org/10.1007/s00606-005-0296-6
. [all data]
Singh, Raina, et al., 2005
Singh, A.K.; Raina, V.K.; Naqvi, A.A.; Patra, N.K.; Kumar, B.; Ram, P.; Khanuja, S.P.S.,
Essential oil composition and chemoarrays of menthol mint (Mentha arvensis L. f. piperascens Malinvaud ex. Holmes) cultivars,
Flavour Fragr. J., 2005, 20, 3, 302-305, https://doi.org/10.1002/ffj.1417
. [all data]
Suárez, Vásquez, et al., 2005
Suárez, A.I.; Vásquez, L.J.; Manzano, M.A.; Compagnone, R.S.,
Essential oil composition of Croton cuneatus and Croton malambo growing in Venezuela,
Flavour Fragr. J., 2005, 20, 6, 611-614, https://doi.org/10.1002/ffj.1498
. [all data]
Urdampilleta, Amat, et al., 2005
Urdampilleta, J.D.; Amat, A.G.; Bidau, C.J.; Koslobsky, N.K.,
Biosystematic and chemosystematic studies in five South Americal species of Conyza (Asteraceae),
Bol. Soc. Argent. Bot., 2005, 40, 1-2, 101-107. [all data]
Limberger, Sobral, et al., 2004
Limberger, R.P.; Sobral, M.; Henriques, A.T.; Menut, C.; Bessière, J.-M.,
Óleos voláteis de espécies de Myrcia nativas do rio grande do sul,
Quim. Nova, 2004, 27, 6, 916-919, https://doi.org/10.1590/S0100-40422004000600015
. [all data]
Suyenaga, Apel, et al., 2004
Suyenaga, E.S.; Apel, M.A.; Chaves, C.G.; Zuanazzi, J.A.; Henriques, A.T.,
Essential oil composition of Heterothalamus psiadioides Less,
Biochem. Syst. Ecol., 2004, 32, 1, 83-86, https://doi.org/10.1016/S0305-1978(03)00190-X
. [all data]
Jirovetz, Buchbauer, et al., 2003
Jirovetz, L.; Buchbauer, G.; Shafi, M.P.; Kaniampady, M.M.,
Chemotaxonomical analysis of the essential oil aroma compounds of four different Ocimumspecies from southern India,
Eur. Food Res. Technol., 2003, 217, 2, 120-124, https://doi.org/10.1007/s00217-003-0708-1
. [all data]
Limberger, Simões-Pires, et al., 2003
Limberger, R.P.; Simões-Pires, C.A.; Sobral, M.; Menut, C.; Bessiere, J.-M.; Henriques, A.T.,
Essential oils of six Gomidesia spp. from southern Brazil,
Flavour Fragr. J., 2003, 18, 2, 144-147, https://doi.org/10.1002/ffj.1122
. [all data]
Gudzic, Djokovic, et al., 2002
Gudzic, B.; Djokovic, D.; Vajs, V.; Palic, R.; Stojanovic, G.,
Composition and antimicrobial activity of the essential oil of Hypericum maculatum Crantz,
Flavour Fragr. J., 2002, 17, 5, 392-394, https://doi.org/10.1002/ffj.1112
. [all data]
Limberger, Simões-Pires, et al., 2002
Limberger, R.P.; Simões-Pires, C.; Sobral, M.; Menu, C.; Bessiere, J.-M.; Henriques, A.T.,
Essential oils from some Myrceugenia species (Myrtaceae),
Flavour Fragr. J., 2002, 17, 5, 341-344, https://doi.org/10.1002/ffj.1113
. [all data]
Phutdhawong, Korth, et al., 2002
Phutdhawong, W.; Korth, J.; Buddhasukh, D.; Pyne, S.G.,
Volatile components from Cephalotaxus griffithii growing in northern Thailand,
Flavour Fragr. J., 2002, 17, 2, 153-155, https://doi.org/10.1002/ffj.1064
. [all data]
Asekun and Ekundayo, 2000
Asekun, O.T.; Ekundayo, O.,
Essential oil constituents of Hyptis suaveolens (L.) Poit. (Bush tea) leaves from Nigeria,
J. Essent. Oil Res., 2000, 12, 227-230. [all data]
Kuiate, Zollo, et al., 1999
Kuiate, J.-R.; Zollo, P.-H.A.; Nguefa, E.H.; Bessière, J.-M.; Lamaty, G.; Menut, C.,
Composition of the essential oils from the leaves of Microglossa pyrifolia (Lam.) O. Kuntze and Helichrysum odoratissimum (L.) Less. growing in Cameroon,
Flavour Fragr. J., 1999, 14, 2, 82-84, https://doi.org/10.1002/(SICI)1099-1026(199903/04)14:2<82::AID-FFJ780>3.0.CO;2-Z
. [all data]
Zollo, Biyiti, et al., 1998
Zollo, P.H.A.; Biyiti, L.; Tchoumbougnang, F.; Menut, C.; Lamaty, G.; Bouchet, Ph.,
Aromatic plants of tropical central Africa. Part XXXII. Chemical composition and antifungal activity of thirteen essential oils from aromatic plants of Cameroon,
Flavour Fragr. J., 1998, 13, 2, 107-114, https://doi.org/10.1002/(SICI)1099-1026(199803/04)13:2<107::AID-FFJ701>3.0.CO;2-G
. [all data]
Malizia, Molli, et al., 1996
Malizia, R.A.; Molli, J.S.; Cardell, D.A.; Retamar, J.A.,
Volatile constituents of the essential oil of Nepeta cataria L. grown in Cordoba Province (Argentina),
J. Essent. Oil Res., 1996, 8, 5, 565-567, https://doi.org/10.1080/10412905.1996.9700691
. [all data]
Perry, Baxter, et al., 1986
Perry, N.B.; Baxter, A.J.; Brennan, N.J.; van Klink, J.W.,
Dalmatian Sage. PArt 1. Differing oil yields and compositions from flowering and non-flowering accessions,
Flavour Fragr. J., 1986, 11, 4, 231-238, https://doi.org/10.1002/(SICI)1099-1026(199607)11:4<231::AID-FFJ572>3.0.CO;2-0
. [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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