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1H-3a,7-Methanoazulene, octahydro-3,8,8-trimethyl-6-methylene-, [3R-(3«alpha»,3a«beta»,7«beta»,8a«alpha»)]-


Normal alkane RI, non-polar column, temperature ramp

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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 CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5DB-5HP-5 MSHP-5 MSDB-5
Column length (m) 30.30.30.30.30.
Carrier gas HeliumHeliumHeliumHeliumHelium
Substrate      
Column diameter (mm) 0.320.250.250.250.25
Phase thickness (mum) 0.250.250.250.250.25
Tstart (C) 60.50.100.70.35.
Tend (C) 240.250.220.290.220.
Heat rate (K/min) 3.2.2.5.3.
Initial hold (min) 2.    
Final hold (min)    10.40.
I 1423.1421.1420.1423.1409.
ReferenceKahriman, Tosun, et al., 2011Ho, Wang, et al., 2010Pripdeevech, Chumpolsri, et al., 2010Radulovic, Blagojevic, et al., 2010El-Massry, El-Ghorab, et al., 2009
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5 MSDB-5 MSHP-5DB-1DB-1
Column length (m) 30.30.30.60.50.
Carrier gas HeliumHeliumN2NitrogenHe
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (mum) 0.250.250.250.250.25
Tstart (C) 50.50.50.60.95.
Tend (C) 230.300.240.250.240.
Heat rate (K/min) 4.5.5.4.4.
Initial hold (min) 4.5.1.1. 
Final hold (min) 10.5.4.10. 
I 1421.1423.1419.1424.1409.
ReferenceForero, Quijano, et al., 2008Noudogbessi, Yedomonhan, et al., 2008Cheraif, Ben Jannet, et al., 2007Ghasempour, Shirinpour, et al., 2007Pala-Paul, Brophy, et al., 2007
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-1DB-5HP-5DB-1BP-1
Column length (m) 60.30.25.30.50.
Carrier gas NitrogenHeHeHeHe
Substrate      
Column diameter (mm) 0.250.250.250.250.22
Phase thickness (mum) 0.250.250.250.250.25
Tstart (C) 60.60.50.50.60.
Tend (C) 250.320.300.265.220.
Heat rate (K/min) 4.10.5.2.52.
Initial hold (min) 1. 5.1. 
Final hold (min) 10.4. 20.20.
I 1424.1423.1424.1408.1419.
ReferenceReza, Ebrahim, et al., 2007Smelcerovic, Spiteller, et al., 2007Champagnat, Figueredo, et al., 2006Iranshahi, Amin, et al., 2006Lesueur, Ban, et al., 2006
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5DB-5DB-1HP-5DB-1
Column length (m) 30.30.50.30.30.
Carrier gas HeHeN2HeHe
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (mum) 0.250.250.250.250.25
Tstart (C) 60.60.95.60.50.
Tend (C) 220.220.240.220.265.
Heat rate (K/min) 4.4.4.5.2.5
Initial hold (min)  5. 10.1.
Final hold (min)     20.
I 1418.1424.1418.1416.1407.
ReferenceMorteza-Semnani, Akbarzadeh, et al., 2006Morteza-Semnani K., Akbarzadeh M., et al., 2006Pala-Paul J., Perez-Alonso M.J., et al., 2006Pintore G., Chessa M., et al., 2006Khanavi, Ghasemian, et al., 2005
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5MSHP-5MSHP-5MSRTX-1DB-1
Column length (m) 30.30.30.60.60.
Carrier gas   HeHeHe
Substrate      
Column diameter (mm) 0.250.20.250.250.25
Phase thickness (mum) 0.25 0.250.250.25
Tstart (C) 50.60.60.60.60.
Tend (C) 250.280.280.25.250.
Heat rate (K/min) 3.3.3.5.5.
Initial hold (min) 10.    
Final hold (min) 5.  10.10.
I 1423.1421.1417.1423.1421.
ReferenceMelkani, Dev, et al., 2005Petrakis, Roussis, et al., 2005Slavkovska, Couladis, et al., 2005Sonboli, Salehi, et al., 2005Sonboli, Salehi, et al., 2005, 2
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase CP Sil 8 CBHP-5RTX-1DB-1HP-5MS
Column length (m) 30.30.30.60.30.
Carrier gas HeHeliumN2HeHe
Substrate      
Column diameter (mm) 0.250.320.320.250.25
Phase thickness (mum)  0.250.250.250.25
Tstart (C) 60.40.60.50.60.
Tend (C) 290.300.300.270.220.
Heat rate (K/min) 3.4.4.4.5.
Initial hold (min) 5.   20.
Final hold (min)  5.  20.
I 1443.1415.1427.1427.1428.
ReferenceSuárez, Vásquez, et al., 2005Utsunomia, Kawata, et al., 2005Lis, Boczek, et al., 2004Nik, Mirza, et al., 2004Feizbaksh, Saber Tehrani, et al., 2003
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5DB-1DB-5DB-5DB-1
Column length (m) 30.60.30.30.50.
Carrier gas HeliumHeHeHeN2
Substrate      
Column diameter (mm) 0.320.250.250.250.25
Phase thickness (mum)  0.250.250.250.25
Tstart (C) 70.50.60.35.80.
Tend (C) 210.280.240.280.225.
Heat rate (K/min) 2.4.3.4.4.
Initial hold (min)    2. 
Final hold (min) 60.  15. 
I 1418.1425.1418.1428.1401.
ReferenceMookdasanit, Tamura, et al., 2003Shahmir, Ahmadi, et al., 2003da Silva, Luz, et al., 2003Krauze-Baranowska, Mardarowicz, et al., 2002Palá-Paúl, Pérez-Alonso, et al., 2002
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillary
Active phase SPB-5DB-5HP-101
Column length (m) 50.30.50.
Carrier gas HeHeH2
Substrate    
Column diameter (mm) 0.320.250.32
Phase thickness (mum) 0.250.250.3
Tstart (C) 60.65.65.
Tend (C) 240.300.300.
Heat rate (K/min) 3.4.2.
Initial hold (min)  2.5.
Final hold (min) 20.  
I 1424.1428.1409.
ReferenceDoneanu and Anitescu, 1998Elias, Simoneit, et al., 1997Demarne and van der Walt, 1993
Comment 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.

Kahriman, Tosun, et al., 2011
Kahriman, N.; Tosun, G.; Terzioglu, S.; Karaoglu, S.A.; Yayh, N., Chemical composition and antimicrobial activity of the essential oils from the flower, leaf, and stem of Senecio pandurifolis, Rec. Nat. Prod., 2011, 5, 2, 82-91. [all data]

Ho, Wang, et al., 2010
Ho, C.-L.; Wang, E.I.-C.; Yu, H.-T.; Yu, H.-M.; Su, Y.-C., Composition amd antioxidant activities of essential oils of different tissues from Cryptomeria japonica D. Don, Quarterly J. Chin. Forestry, 2010, 32, 1, 63-76. [all data]

Pripdeevech, Chumpolsri, et al., 2010
Pripdeevech, P.; Chumpolsri, W.; Suttiarporn, P.; Wongpornchai, S., The chemical composition and antioxidant activities of Basil from Thailand using retention indices and comprehensive two-dimensional gas chromatography, J. Seb. Chem. Soc., 2010, 75, 11, 1503-1513, https://doi.org/10.2298/JSC100203125P . [all data]

Radulovic, Blagojevic, et al., 2010
Radulovic, N.; Blagojevic, P.; Palic, R., Comparative study of the leaf volatiles of Arctostaphylos uva-ursi (L.) Spreng. and Vaccinium vitis-idaea L. (Ericaceae), Molecules, 2010, 15, 9, 6168-6185, https://doi.org/10.3390/molecules15096168 . [all data]

El-Massry, El-Ghorab, et al., 2009
El-Massry, K.F.; El-Ghorab, A.H.; Shaaban, H.A.; Shibamoto, T., Chemical compositions and antioxidant/antimicrobial activities of various samples prepared from Schinus terebinthifolius leaves cultivated in Egipt, J. Agric. Food Chem., 2009, 57, 12, 5265-5270, https://doi.org/10.1021/jf900638c . [all data]

Forero, Quijano, et al., 2008
Forero, M.D.; Quijano, C.E.; Pino, J.A., Volatile compounds of Chile pepper (Capsicum annuum L. var. glabriusculum) at two ripening stages, Flavour Fragr. J., 2008, 24, 1, 25-30, https://doi.org/10.1002/ffj.1913 . [all data]

Noudogbessi, Yedomonhan, et al., 2008
Noudogbessi, J.-P.; Yedomonhan, P.; Sohounhloue, D.C.K.; Chalchat, J.-C.; Figueredo, G., Chemical composition of essential oil of syzygium guineense (Willd.) DC. var. guineense (Myrtaceae) from Benin, Rec. Nat. Prod., 2008, 33-38. [all data]

Cheraif, Ben Jannet, et al., 2007
Cheraif, I.; Ben Jannet, H.; Hammami, M.; Khouja, M.L.; Mighri, Z., Chemical composition and antimicrobial activity of essential oils of Cupressus arizonica Greene, Biochem. Syst. Ecol., 2007, 35, 12, 813-820, https://doi.org/10.1016/j.bse.2007.05.009 . [all data]

Ghasempour, Shirinpour, et al., 2007
Ghasempour, H.R.; Shirinpour, E.; Heidari, H., The constituents of essential oils of Ferulago angulata (Schlecht.) Boiss at two different habitats, Nevakoh and Shahoo, Agross mountain, Western Iran, Iranian J. Sci. Technol., 2007, 31, A3, 309-312. [all data]

Pala-Paul, Brophy, et al., 2007
Pala-Paul, J.; Brophy, J.J.; Perez-Alonso, M.J.; Usano, J.; Soria, S.C., Essential oil composition of the different parts of Eryngium corniculatum Lam. (Apiaceae) from Spain, J. Chromatogr. A, 2007, 1175, 2, 289-293, https://doi.org/10.1016/j.chroma.2007.10.061 . [all data]

Reza, Ebrahim, et al., 2007
Reza, G.H.; Ebrahim, S.; Hossein, H., Analysis by gas chromatography - mass spectrometry of essential oil from seeds and aerial parts of Ferulago angulata (Schlecht.) Boiss gatheres in Nevakoh and Shahoo, Zagross mountain, west of Iran, Pakistan J. Biol. Sci., 2007, 10, 5, 814-817, https://doi.org/10.3923/pjbs.2007.814.817 . [all data]

Smelcerovic, Spiteller, et al., 2007
Smelcerovic, A.; Spiteller, M.; Ligon, A.P.; Smelcerovic, Z.; Raabe, N., Essential oil composition of Hypericum L. species from Southeastern Serbia and their chemotaxonomy, Biochem. Syst. Ecol., 2007, 35, 2, 99-113, https://doi.org/10.1016/j.bse.2006.09.012 . [all data]

Champagnat, Figueredo, et al., 2006
Champagnat, P.; Figueredo, G.; Chalchat, J.-C.; Bessiere, J.-M., Essential oil composition of Vetiveria nigritana from Mali, J. Essent. Oil Res., 2006, 18, 6, 647-649, https://doi.org/10.1080/10412905.2006.9699193 . [all data]

Iranshahi, Amin, et al., 2006
Iranshahi, M.; Amin, G.; Sourmaghi, M.S.; Shafiee, A.; Hadjiakhoondi, A., Sulphur-containing compounds in the essential oil of the root of Ferula persica Willd. var. persica, Flavour Fragr. J., 2006, 21, 2, 260-261, https://doi.org/10.1002/ffj.1574 . [all data]

Lesueur, Ban, et al., 2006
Lesueur, D.; Ban, N.K.; Bighelli, A.; Muselli, A.; Casanova, J., Analysis of the root oil of Fokienia hodginsii (Dunn) Henry et Thomas (Cupressaceae) by GC, GC-MS and 13C-NMR, Flavour Fragr. J., 2006, 21, 1, 171-174, https://doi.org/10.1002/ffj.1557 . [all data]

Morteza-Semnani, Akbarzadeh, et al., 2006
Morteza-Semnani, K.; Akbarzadeh, M.; Changizi, S., Essential oils composition of Stachys byzantina, S. inflata, S. lavandulifolia and S. laxa from Iran, Flavour Fragr. J., 2006, 21, 2, 300-303, https://doi.org/10.1002/ffj.1594 . [all data]

Morteza-Semnani K., Akbarzadeh M., et al., 2006
Morteza-Semnani K.; Akbarzadeh M.; Moshiri K., The essential oil composition of Eupatorium cannabinum L. from Iran, Flavour Fragr. J., 2006, 21, 3, 521-523, https://doi.org/10.1002/ffj.1687 . [all data]

Pala-Paul J., Perez-Alonso M.J., et al., 2006
Pala-Paul J.; Perez-Alonso M.J.; Velasco-Negueruela A.; Ballesteros M.T.; Sanz J., Essential oil composition of Sideritis hirsuta L. from Guadalajara Province, Spain, Flavour Fragr. J., 2006, 21, 3, 410-415, https://doi.org/10.1002/ffj.1727 . [all data]

Pintore G., Chessa M., et al., 2006
Pintore G.; Chessa M.; Manconi P.; Zanetti S.; Deriu A.; Tirillini B., Chemical composition and antimicrobial activities of essential oil of stachys glutinosa L. from Sardinia, Natural Product Communications, 2006, 1, 12, 1133-1136. [all data]

Khanavi, Ghasemian, et al., 2005
Khanavi, M.; Ghasemian, L.; Motlagh, E.H.; Hadjiakhoondi, A.; Shafiee, A., Chemical composition of the essential oils of Marrubium parviflorum Fisch. C.A. Mey. and Marrubium vulgare L. from Iran, Flavour Fragr. J., 2005, 20, 3, 324-326, https://doi.org/10.1002/ffj.1425 . [all data]

Melkani, Dev, et al., 2005
Melkani, A.B.; Dev, V.; Beauchamp, P.S.; Negi, A.; Mehta, S.P.S.; Melkani, K.B., Constituents of the essential oil of a new chemotype of Elsholtzia strobilifera Benth., Biochem. Syst. Ecol., 2005, 33, 4, 419-425, https://doi.org/10.1016/j.bse.2004.10.009 . [all data]

Petrakis, Roussis, et al., 2005
Petrakis, P.V.; Roussis, V.; Papadimitriou, D.; Vagias, C.; Tsitsimpikou, C., The effect of terpenoid extracts from 15 pine species on the feeding behavioural sequence of the late instars of the pine processionary caterpillar Thaumetopoea pityocampa, Behav. Processes, 2005, 69, 3, 303-322, https://doi.org/10.1016/j.beproc.2004.12.008 . [all data]

Slavkovska, Couladis, et al., 2005
Slavkovska, V.; Couladis, M.; Bojovic, S.; Tzakou, O.; Pavlovic, M.; Lakusic, B.; Jancic, R., Essential oil and its systematic significance in species of Micromeria Bentham from Serbia Montenegro, Plant Systematics and Evolution, 2005, 255, 1-2, 1-15, https://doi.org/10.1007/s00606-005-0303-y . [all data]

Sonboli, Salehi, et al., 2005
Sonboli, A.; Salehi, P.; Ebrahimi, S.N., Essential oil composition and antibacterial activity of the leaves of Stachys schtschegleevii from Iran, Chem. Nat. Compd. (Engl. Transl.), 2005, 41, 2, 171-175, https://doi.org/10.1007/s10600-005-0105-z . [all data]

Sonboli, Salehi, et al., 2005, 2
Sonboli, A.; Salehi, P.; Allahyari, L., Essential oil composition of Nepeta involucrata from Iran, Chem. Nat. Compd. (Engl. Transl.), 2005, 41, 6, 683-685, https://doi.org/10.1007/s10600-006-0011-z . [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]

Utsunomia, Kawata, et al., 2005
Utsunomia, H.; Kawata, J.; Chanoki, W.; Shirakawa, N.; Miyazawa, M., Components of Essential Oil from Woods of Prunus mume Sieb. at Zucc., J. Oleo Sci., 2005, 54, 11, 609-612, https://doi.org/10.5650/jos.54.609 . [all data]

Lis, Boczek, et al., 2004
Lis, A.; Boczek, E.; Góra, J., Chemical composition of the essential oils from fruits, leaves and flowers of the Amur cork tree (Phellodendron amurense Rupr.), Flavour Fragr. J., 2004, 19, 6, 549-553, https://doi.org/10.1002/ffj.1349 . [all data]

Nik, Mirza, et al., 2004
Nik, Z.B.; Mirza, M.; Shahmir, F., Essential oil of Marrubium cuneatum Russell and its secretory elements, Flavour Fragr. J., 2004, 19, 3, 233-235, https://doi.org/10.1002/ffj.1293 . [all data]

Feizbaksh, Saber Tehrani, et al., 2003
Feizbaksh, A.; Saber Tehrani, M.; Rustaiyan, A.; Masoudi, S., Composition of the essential oil of Stachys lavandulifolia Vahl. from Iran, J. Essent. Oil Res., 2003, 15, 2, 72-73, https://doi.org/10.1080/10412905.2003.9712068 . [all data]

Mookdasanit, Tamura, et al., 2003
Mookdasanit, J.; Tamura, H.; Yoshizawa T.; Tokunaga T.; Nakanishi, K., Trace Volatile Compounds in Essential Oil of Citrus Sudachi by Means of Modified Solvent Extraction Method, Food Sci Technol. Res., 2003, 9, 1, 54-61, https://doi.org/10.3136/fstr.9.54 . [all data]

Shahmir, Ahmadi, et al., 2003
Shahmir, F.; Ahmadi, L.; Mirza, M.; Korori, S.A.A., Secretory elements of needles and berries of Juniperus communis L. ssp. communis and its volatile constituents, Flavour Fragr. J., 2003, 18, 5, 425-428, https://doi.org/10.1002/ffj.1243 . [all data]

da Silva, Luz, et al., 2003
da Silva, J.D.; Luz, A.I.R.; da Silva, M.H.L.; Andrade, E.H.A.; Soghbi, M.G.B.; Maia, J.G.S., Essential oils of the leaves and stems of four Psidium spp., Flavour Fragr. J., 2003, 18, 3, 240-243, https://doi.org/10.1002/ffj.1219 . [all data]

Krauze-Baranowska, Mardarowicz, et al., 2002
Krauze-Baranowska, M.; Mardarowicz, M.; Wiwart, M., The chemical composition of Microbiota decussata, Z. Naturforsch. C:, 2002, 57c, 998-1003. [all data]

Palá-Paúl, Pérez-Alonso, et al., 2002
Palá-Paúl, J.; Pérez-Alonso, M.J.; Velasco-Negueruela, A.; Sanz, J., Analysis by gas chromatography-mass spectrometry of the volatile components of Ageratina adenophora Spreng., growing in the Canary Islands, J. Chromatogr. A, 2002, 947, 2, 327-331, https://doi.org/10.1016/S0021-9673(02)00016-X . [all data]

Doneanu and Anitescu, 1998
Doneanu, C.; Anitescu, G., Supercritical carbon dioxide extraction of Angelica archangelica L. root oil, J. Supercrit. Fluids, 1998, 12, 1, 59-67, https://doi.org/10.1016/S0896-8446(97)00040-5 . [all data]

Elias, Simoneit, et al., 1997
Elias, V.O.; Simoneit, B.R.T.; Cardoso, J.N., Analysis of volatile sesquiterpenoids in environmental and geological samples, J. Hi. Res. Chromatogr., 1997, 20, 6, 305-309, https://doi.org/10.1002/jhrc.1240200602 . [all data]

Demarne and van der Walt, 1993
Demarne, F.-E.; van der Walt, J.J.A., Composition of the Essential Oil of Pelargonium citronellum (Geraniaceae), J. Essent. Oil Res., 1993, 5, 3, 233-238, https://doi.org/10.1080/10412905.1993.9698214 . [all data]


Notes

Go To: Top, Normal alkane RI, non-polar column, temperature ramp, References