δ-Selinene
- Formula: C15H24
- Molecular weight: 204.3511
- IUPAC Standard InChI: InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h10-11H,5-9H2,1-4H3
- IUPAC Standard InChIKey: VEGYMPQCXPVQJY-UHFFFAOYSA-N
- CAS Registry Number: 28624-23-9
- 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. - Species with the same structure:
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Mass spectrum (electron ionization)
Go To: Top, Gas Chromatography, 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
Spectrum
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Additional Data
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| Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
|---|---|
| Origin | N.W. DAVIES, UNIVERSITY OF TASMANIA, TASMANIA, AUSTRALIA |
| NIST MS number | 70257 |
Gas Chromatography
Go To: Top, Mass spectrum (electron ionization), 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, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-1 | 1496. | Mevy, Bessiere, et al., 2006 | He, 60. C @ 3. min, 3. K/min; Column length: 25. m; Column diameter: 0.2 mm; Tend: 220. C |
| Capillary | DB-1 | 1478. | Palá-Paúl, Velasco-Negueruela, et al., 2001 | 50. m/0.25 mm/0.25 μm, N2, 4. K/min; Tstart: 80. C; Tend: 225. C |
| Capillary | HP-5MS | 1485. | Siani, Ramos, et al., 1999 | 30. m/0.32 mm/0.25 μm, He, 70. C @ 5. min, 3. K/min; Tend: 250. C |
Kovats' RI, polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Packed | Carbowax 20M | 165. | 1728. | Andersen and Falcone, 1969 |
Van Den Dool and Kratz RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-1 | 1509. | Fanciullino, Gancel, et al., 2005 | 30. m/0.25 mm/0.25 μm, He, 3. K/min, 250. C @ 20. min; Tstart: 40. C |
| Capillary | HP-5 | 1493. | Javidnia, Miri, et al., 2005 | He, 3. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 60. C; Tend: 260. C |
| Capillary | DB-5MS | 1475. | Yu, Kim, et al., 2004 | 30. m/0.25 mm/0.25 μm, He, 40. C @ 5. min, 4. K/min, 200. C @ 20. min |
| Capillary | DB-1 | 1509. | Gancel, Ollitrault, et al., 2003 | 30. m/0.25 mm/0.25 μm, He, 3. K/min, 250. C @ 20. min; Tstart: 40. C |
| Capillary | HP-5 | 1491. | Karioti, Skaltsa, et al., 2003 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 4. K/min; Tend: 280. C |
Van Den Dool and Kratz RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | BPX-5 | 1501. | Cardeal, da Silva, et al., 2006 | 30. m/0.25 mm/0.25 μm; Program: 35C(5min) => 3C/min => 210C => 40C/min => 240C (4min) |
| Capillary | HP-5MS | 1493. | Akpulat, Tepe, et al., 2005 | 30. m/0.25 mm/0.25 μm, He; Program: 50C (3min) => 3C/min => 200C => 6C/min => 240C |
Van Den Dool and Kratz RI, polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-Wax | 1756. | Fanciullino, Gancel, et al., 2005 | 30. m/0.25 mm/0.25 μm, He, 3. K/min, 250. C @ 20. min; Tstart: 40. C |
| Capillary | DB-Wax | 1756. | Gancel, Ollitrault, et al., 2003 | 60. m/0.32 mm/0.25 μm, H2, 1.5 K/min, 245. C @ 20. min; Tstart: 40. C |
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-5 MS | 1500. | Radulovic, Blagojevic, et al., 2010 | 30. m/0.25 mm/0.25 μm, Helium, 5. K/min, 290. C @ 10. min; Tstart: 70. C |
| Capillary | SE-54 | 1485. | Dayisoylu and Alma, 2009 | 30. m/0.25 mm/0.25 μm, Helium, 60. C @ 5. min, 2. K/min, 260. C @ 999. min |
| Capillary | DB-5 | 1493. | Scrivanti, Anton, et al., 2009 | 30. m/0.25 mm/0.25 μm, Nitrogen, 2. K/min; Tstart: 40. C; Tend: 230. C |
| Capillary | VF-5MS | 1497. | Kowalski, 2008 | 30. m/0.25 mm/0.25 μm, Helium, 240. C @ 1. min, 20. K/min; Tend: 320. C |
| Capillary | Elite-1 | 1489. | Raj, Baby, et al., 2008 | 30. m/0.32 mm/0.25 μm, Helium, 3. K/min; Tstart: 60. C; Tend: 246. C |
| Capillary | AT-5 | 1494. | Meccia, Rojas, et al., 2007 | 60. m/0.25 mm/0.25 μm, Helium, 4. K/min; Tstart: 60. C; Tend: 260. C |
| Capillary | CP Sil 5 CB | 1493. | Hymete, Rohloff, et al., 2006 | 30. m/0.25 mm/0.25 μm, 3. K/min, 220. C @ 3. min; Tstart: 40. C |
| Capillary | DB-5 | 1497. | Morteza-Semnani K., Akbarzadeh M., et al., 2006 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 4. K/min; Tend: 220. C |
| Capillary | DB-5 | 1496. | Chagonda and Chalchat, 2005 | 25. m/0.25 mm/0.15 μm, 40. C @ 5. min, 3. K/min; Tend: 220. C |
| Capillary | DB-5 | 1479. | Ferraz, Limberger, et al., 2005 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 3. min, 3. K/min; Tend: 300. C |
| Capillary | HP-5MS | 1483. | Gauvin and Smadja, 2005 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 30. min, 4. K/min; Tend: 200. C |
| Capillary | DB-5 | 1497. | Kowalski and Wolski, 2005 | 30. m/0.25 mm/0.25 μm, 35. C @ 2. min, 4. K/min; Tend: 280. C |
| Capillary | DB-5 | 1497. | Kowalski, 2005 | 30. m/0.25 mm/0.25 μm, Helium, 35. C @ 2. min, 4. K/min; Tend: 280. C |
| Capillary | DB-5 | 1505. | Tellez M., Estell R., et al., 2001 | 30. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 60. C; Tend: 240. C |
| Capillary | DB-1 | 1514. | Bailac, Dellacasa, et al., 1999 | 60. m/0.25 mm/0.25 μm, N2, 75. C @ 1. min, 4. K/min, 220. C @ 8. min |
| Capillary | DB-5 | 1506. | Tellez, Estell, et al., 1997 | 30. m/0.25 mm/0.25 μm, Helium, 3. K/min; Tstart: 60. C; Tend: 240. C |
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | 5 % Phenyl polydimethyl siloxane | 1489. | Chaverri, Diaz, et al., 2011 | Program: not specified |
| Capillary | CBP-5 | 1492. | Fortes, Naves, et al., 2011 | 30. m/0.25 mm/0.25 μm, Helium; Program: 60 0C 3 0C/min -> 246 0C 10 0C/min -> 270 0C (5 min) |
| Capillary | HP-5 MS | 1493. | Nance and Setzer, 2011 | 30. m/0.25 mm/0.25 μm, Helium; Program: 40 0C (10 min) 3 0C/min -> 200 0C 2 0C/min -> 220 0C |
| Capillary | HP-5 MS | 1503. | Payo, Colo, et al., 2011 | Program: not specified |
| Capillary | HP-5 MS | 1504. | Payo, Colo, et al., 2011 | Program: not specified |
| Capillary | HP-5 MS | 1506. | Payo, Colo, et al., 2011 | Program: not specified |
| Capillary | DB-5 | 1492. | Courtois, Paine, et al., 2009 | 30. m/0.25 mm/0.25 μm, Helium; Program: 50 0C m6 0C/min -> 140 0C 5 0C/min -> 160 0C (1 min) 10 0C/min -> 200 0C |
| Capillary | HP-5 | 1482. | Custer, 2009 | 25. m/0.32 mm/0.17 μm, Helium; Program: 60 0C (5 min) 4 0C/min -> 220 0C 11 0C/min -> 280 0C (15 min) |
| Capillary | HP-5 | 1492. | Custer, 2009 | 25. m/0.32 mm/0.17 μm, Helium; Program: not specified |
| Capillary | DB-1 | 1483. | Nogueira, Marcelo-Curto, et al., 2008 | 30. m/0.25 mm/0.25 μm, He; Program: 45C => 3C/min => 175C => 15C/min => 300C (10min) |
| Capillary | Elite-1 | 1493. | Raj, Baby, et al., 2008 | 30. m/0.32 mm/0.25 μm, Helium; Program: not specified |
| Capillary | HP-5 MS | 1487. | Eason and Setzer, 2007 | 30. m/0.25 mm/0.25 μm, Helium; Program: 40 0C (10 min) 3 0C/min -> 200 0C 2 0C/min -> 220 0C |
| Capillary | CP-Sil | 1492. | Proffit, 2007 | 30. m/0.25 mm/0.25 μm, Helium; Program: 50 0C (3 min) 3 0C/min -> 100 0C 2.7 0C/min -> 140 0C 2.4 0C/min -> 180 0C 6 0C/min -> 250 0C |
| Capillary | 5 % Phenyl methylsiloxane | 1520. | Serrano, Cornu, et al., 2007 | Program: not specified |
| Capillary | HP-5MS | 1493. | Takaku, Haber, et al., 2007 | He; Column length: 30. m; Column diameter: 0.25 mm; Program: 40C(10min) => 3C/min => 200C => 2C/min => 220C |
| Capillary | DB-5 | 1493. | Letchamo, Ward, et al., 2004 | 30. m/0.25 mm/0.25 μm, He; Program: 60C(4min) => 6C/min => 240 => 10C/min => 280C |
| Capillary | SE-30 | 1505. | Vinogradov, 2004 | Program: not specified |
| Capillary | CP Sil 5 CB | 1484. | Weyerstahl, Marschall, et al., 2000 | Column length: 25. m; Program: not specified |
| Capillary | Methyl Silicone | 1505. | Zenkevich, 1996 | Program: not specified |
Normal alkane RI, polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-Wax | 1755. | Niponsak, Laohakunjit, et al., 2011 | 30. m/0.25 mm/0.25 μm, 5. K/min, 240. C @ 5. min; Tstart: 40. C |
Normal alkane RI, polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | Carbowax 20M | 1728. | Vinogradov, 2004 | Program: not specified |
| Capillary | Innowax FSC | 1707. | Baser, Demirei, et al., 2002 | 60. m/0.25 mm/0.25 μm, He; Program: 60C(10min) => 4C/min => 220C(10min) => 1C/min => 240C |
References
Go To: Top, Mass spectrum (electron ionization), Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Mevy, Bessiere, et al., 2006
Mevy, J.P.; Bessiere, J.M.; Rabier, J.; Dherbomez, M.; Ruzzier, M.; Millogo, J.; Viano, J.,
Composition and antimicrobial activities of the essential oil of Triumfetta rhomboidea Jacq.,
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Palá-Paúl, Velasco-Negueruela, et al., 2001
Palá-Paúl, J.; Velasco-Negueruela, A.; Pérez-Alonso, M.J.; Sanz, J.,
Analysis of the volatile components of Argyranthemum adauctum (Link.) Humphries by gas chromatography-mass spectrometry,
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Siani, Ramos, et al., 1999
Siani, A.C.; Ramos, M.F.S.; Menezes-de-Lima, O., Jr.; Ribeiro-dos-Santos, R.; Fernadez-Ferreira, E.; Soares, R.O.A.; Rosas, E.C.; Susunaga, G.S.; Guimarães, A.C.; Zoghbi, M.G.B.; Henriques, M.G.M.O.,
Evaluation of anti-inflammatory-related activity of essential oils from the leaves and resin of species of Protium,
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Andersen and Falcone, 1969
Andersen, N.H.; Falcone, M.S.,
The identification of sesquiterpene hydrocarbons from gas-liquid chromatography retention data,
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Fanciullino, Gancel, et al., 2005
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Effects of Nucleo-cytoplasmic Interactions on Leaf Volatile Compounds from Citrus Somatic Diploid Hybrids,
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Javidnia, Miri, et al., 2005
Javidnia, K.; Miri, R.; Jamalian, A.,
Composition of the essential oil of Salvia macrosiphon Boiss. from Iran,
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Yu, Kim, et al., 2004
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Gancel, A.-L.; Ollitrault, P.; Froelicher, Y.; Tomi, F.; Jacquemond, C.; Luro, F.; Brillouet, J.-M.,
Leaf volatile compounds of seven citrus somatic tetraploid hybrids sharing willow leaf mandarin (Citrus deliciosa Ten.) as their common parent,
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Karioti, A.; Skaltsa, H.; Demetzos, C.; Perdetzoglou, D.; Economakis, C.D.; Salem, A.B.,
Effect of nitrogen concentration of the nutrient solution on the volatile constituents of leaves of Salvia fruticosa Mill. in solution culture,
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Comprehensive two-dimensional gas chromatography/mass spectrometric analysis of pepper volatiles,
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Composition of the essential oils of Tanacetum argyrophyllum (C. Koch) Tvzel. var. argyrophyllum and Tanacetum parthenium (L.) Schultz Bip. (Asteraceae) from Turkey,
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Comparative study of the leaf volatiles of Arctostaphylos uva-ursi (L.) Spreng. and Vaccinium vitis-idaea L. (Ericaceae),
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Chemical analysis of essential oils from cone's rosin of Cilician fir (Abies cilicica subsp. cilicica),
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Scrivanti, L.R.; Anton, A.M.; Zygadlo, J.A.,
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Kowalski, 2008
Kowalski, R.,
Antimicrobial activity of essential oils and extracts of rosinweed (Silphoum trifoliatum and Silphium integrifolium) plants used by the American Indians,
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Raj, Baby, et al., 2008
Raj, G.; Baby, S.; Dan, M.; Thaha, A.R.M.; Sethuraman, M.G.; George, V.,
Volatile constituents from the rhisomes of Curcuma haritha Mangaly and Sabu from Sauthern India,
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Meccia, Rojas, et al., 2007
Meccia, G.; Rojas, L.B.; Velasco, J.; Diaz, T.; Usubillaga, A.,
Composition and antibacterial screening of the essential oils of leaves and roots of Espeletiopsis angustifolia Cuetrec,
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Hymete, Rohloff, et al., 2006
Hymete, A.; Rohloff, J.; Iversen, T.-H.,
Essential oil from seeds and husks of Aframomum corrorima from Ethiopia,
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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,
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Chagonda and Chalchat, 2005
Chagonda, L.S.; Chalchat, J.-C.,
The essential oil of the fruit of Garcinia huillensis Welw. ex. Oliv. from Zimbabwe,
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Gauvin and Smadja, 2005
Gauvin, A.; Smadja, J.,
Essential oil composition of four Psiadia species from Reunion Island: A chemotaxonomic study,
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Kowalski and Wolski, 2005
Kowalski, R.; Wolski, T.,
The chemical composition of essential oils of Silphium perfoliatum L.,
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Kowalski, 2005
Kowalski, R.,
Analysis of lipophylic fraction from leaves, inflorescences and rhizomes of Siphium perfoliatum L.,
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Tellez M., Estell R., et al., 2001
Tellez M.; Estell R.; Fredrickson E.; Powell J.; Wedge D.; Schrader K.; Kobaisy M.,
Extracts of Flourensia cernua (L): Volatile constituents and antifungal, antialgal, and antitermite bioactivities,
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Bailac, Dellacasa, et al., 1999
Bailac, P.N.; Dellacasa, A.D.; Duschatzky, C.B.; Firpo, N.; Ponzi, M.I.,
Composicion del aceite esencial y actividad antimicrobiana de Aloysia gratissima de San Luis - Argentina,
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Tellez, Estell, et al., 1997
Tellez, M.R.; Estell, R.E.; Frederickson, E.L.; Havstad, K.M.,
Essntial oil of Flourensia cernua DC,
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Chaverri, Diaz, et al., 2011
Chaverri, C.; Diaz, C.; Cicco, J.F.,
Chemical analysis of essential oils from Ocotea gomezii W.C. Burger and Ocotea morae Gomez-Laur. (Lauraceae) collected at Reserva biologica Alberto M. Brenes in Costa Rica and their cytotoxic activity on Tumor cell lines,
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Fortes, Naves, et al., 2011
Fortes, G.A.C.; Naves, S.S.; Godoi, F.F.F.; Duarte, A.R.; Ferri, P.H.; Santos, S.C.,
Assessment of a maturity index in Jabuticaba fruit by the evaluation of phenolic compounds, essential oil components, sugar content and total acidity,
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. [all data]
Nance and Setzer, 2011
Nance, M.R.; Setzer, W.N.,
Volatile components of aroma hops (Humulus lupulus L.) commonly used in beer brewing,
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Payo, Colo, et al., 2011
Payo, D.A.; Colo, J.; Calumpong, H.; de Clerck, O.,
Variability of non-polar secondary metabolites in the Red Alga Portieria,
Mar Drugs, 2011, 9, 11, 2438-2468, https://doi.org/10.3390/md9112438
. [all data]
Courtois, Paine, et al., 2009
Courtois, E.A.; Paine, C.E.; Blandinieres, P.-A.; Stien, D.; Bessiere, J.-M.; Houel, E.; Baraloto, C.; Chave, J.,
Diversity of the volatile organic compounds emitted by 55 species of tropical trees: a survey in French Guiana,
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Custer, 2009
Custer, Y.,
GC Volatile Components Analysis of Different Parts of Litchi chinensis (Dissertation), 2009. [all data]
Nogueira, Marcelo-Curto, et al., 2008
Nogueira, T.; Marcelo-Curto, M.J.; Cristina Figueiredo, A.; Barroso, J.G.; Pedro, L.G.; Rubiolo, P.; Bicchi, C.,
Chemotaxonomy of Hypericum genus from Portugal: Geographical distribution and essential oils composition of Hypericum perfoliatum, Hypericum humifusum, Hypericum linarifolium and Hypericum pulchrum,
Biochem. Syst. Ecol., 2008, 36, 1, 40-50, https://doi.org/10.1016/j.bse.2007.07.004
. [all data]
Eason and Setzer, 2007
Eason, H.M.; Setzer, W.N.,
BArk essential oil composition of Cedrela tinduzii C. DC. (Meliaceae) from Monteverde, Costa Rica,
Rec. NAt. Prod., 2007, 1, 2-3, 24-27. [all data]
Proffit, 2007
Proffit, M.,
Mediation chimique et structuration des communautes d'hymenopteres parasites du mutualisme figuier / pollinisateur (These pour obtenir le grade de Docteur de l'Universite Montpellier II) (Dissertation), 2007. [all data]
Serrano, Cornu, et al., 2007
Serrano, E.; Cornu, A.; Kondjoyan, N.; Figueredo, G.; Agabriel, J.; Micol, D.,
Terpene accumulation in muscle and fatty tissues of calves supplement with essential oils,
J. Animal Feed Sci., 2007, 16, 168-179. [all data]
Takaku, Haber, et al., 2007
Takaku, S.; Haber, W.A.; Setzer, W.N.,
Leaf essential oil composition of 10 species of Ocotea (Lauraceae) from Monteverde, Costa Rica,
Biochem. Syst. Ecol., 2007, 35, 8, 525-532, https://doi.org/10.1016/j.bse.2007.02.003
. [all data]
Letchamo, Ward, et al., 2004
Letchamo, W.; Ward, W.; Heard, B.; Heard, D.,
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Zenkevich, I.G.,
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Niponsak, Laohakunjit, et al., 2011
Niponsak, A.; Laohakunjit, N.; kerdchoechuen, O.,
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Notes
Go To: Top, Mass spectrum (electron ionization), Gas Chromatography, References
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