3-Hexen-1-ol, (Z)-

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Normal alkane RI, non-polar column, custom temperature program

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 CapillaryCapillaryCapillaryCapillaryCapillary
Active phase Polydimethyl siloxane with 5 % Ph groupsPolydimethyl siloxane with 5 % Ph groupsSiloxane, 5 % PhCP-Sil 8 CBHP-5
Column length (m)    30.30.
Carrier gas    HydrogenNitrogen
Substrate      
Column diameter (mm)    0.250.25
Phase thickness (μm)    0.250.25
Program not specifiednot specifiednot specified30 0C 3 0C/min -> 150 0C 20 0C/min -> 220 0C35 0C (10 min) 3 0C/min -> 205 0C 10 0C/min -> 225 0C
I 860.864.854.858.855.
ReferenceRobinson, Adams, et al., 2012Robinson, Adams, et al., 2012VOC BinBase, 2012de Freitas, Garruti, et al., 2011Laribi, Kouki, et al., 2011
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase Polydimethyl siloxane, 5 % phenylDB-1-MSDB-5RTX-5RTX-5
Column length (m)  60.30.30.30.
Carrier gas  HeliumHeliumNitrogenNitrogen
Substrate      
Column diameter (mm)  0.250.250.250.25
Phase thickness (μm)  0.250.250.250.25
Program not specifiednot specified50 0C m6 0C/min -> 140 0C 5 0C/min -> 160 0C (1 min) 10 0C/min -> 200 0C60 0C 95 min) 110 0C 3 0C/min -> 200 0C 5 0C/min -> 220 0C 95 min)not specified
I 854.834.864.849.859.
ReferenceSkogerson, Wohlgemuth, et al., 2011Takeoka, Hobbs, et al., 2010Courtois, Paine, et al., 2009Leela, Vipin, et al., 2009Leela, Vipin, et al., 2009
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5HP-1CB-1CB-1DB-1
Column length (m) 25.50.30.30.30.
Carrier gas HeliumHeliumHeliumHeliumHe
Substrate      
Column diameter (mm) 0.320.200.250.250.25
Phase thickness (μm) 0.170.330.250.250.25
Program 60 0C (5 min) 4 0C/min -> 220 0C 11 0C/min -> 280 0Cnot specified40 0C (2 min) 4 0C/min -> 180 0C 20 0C/min -> 220 0C (1 min)not specified45C => 3C/min => 175C => 15C/min => 300C (10min)
I 860.839.836.851.868.
ReferenceMaggi, Bilek, et al., 2009Breme, Langle, et al., 2008Kannaste, Vongvanich, et al., 2008Kannaste, Vongvanich, et al., 2008Nogueira, Marcelo-Curto, et al., 2008
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase CP-Sil 8CB-MSHP-5HP-5DB-5 MSDB-5 MS
Column length (m) 30.30.30.30.30.
Carrier gas Helium  HeliumHelium
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (μm) 0.250.250.250.250.25
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 -> 260 0C40 0C (2 min) 5 0C/min -> 80 0C 7 oC/min -> 160 0C 9 0C/min -> 200 0C 20 0C/min -> 280 0C (10 min)not specified50 0C (2.8 min) 5.5 0C/min -> 140 0C (1 min) 4.5 oC/min -> 220 0C -> 225 0C (2 min) 3.4 0C/min -> 265 0C (5 min)50 0C (2.8 min) 5.5 0C/min -> 140 0C (1 min) 4.5 oC/min -> 220 0C -> 225 0C (2 min) 3.4 0C/min -> 265 0C (5 min)
I 857.864.860.836.851.
ReferenceProfitt, Schatz, et al., 2008Zhao, Li, et al., 2008Zhao, Li, et al., 2008Zhu, Li, et al., 2008Zhu, Li, et al., 2008
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-1SPB-1HP-5MSHP-5MSHP-5
Column length (m) 50.30.30.30.30.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.20.250.250.250.32
Phase thickness (μm) 0.330.250.250.250.25
Program 40C(2min) => 2C/min => 200C => 15C/min => 250C (30min)40C(10min) => 2C/min => 200C(1min) => 2C/min => 250C (10min)40C => 3C/min => 100C => 5C/min => 230C(2min)40C(10min) => 3C/min => 200C => 2C/min => 220C40 0C (2 min) 110 0C (2 min) 3 0C/min -> 170 0C (2 min) 4 0C/min -> 220 0C (2 min) 10 0C/min -> 260 0C (5 min)
I 839.853.857.855.862.
ReferenceBarra, Baldovini, et al., 2007Bosch-Fuste, Riu-Aumatell, et al., 2007Chokeprasert P., Charles A.L., et al., 2007Cole, Haber, et al., 2007Dou, Li, et al., 2007
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5MSCP Sil 8 CBHP-5 MSCP-SilCP-Sil
Column length (m)  30.30.30.30.
Carrier gas  HeHeliumHeliumHelium
Substrate      
Column diameter (mm)  0.250.250.250.25
Phase thickness (μm)  0.250.250.250.25
Program not specified50C(3min) => 3C/min => 100C => 2.7C/min => 140C => 2.4C/min => 180C => 6C/min => 250C40 0C (10 min) 3 0C/min -> 200 0C 2 0C/min -> 220 0C50 0C (3 min) 3 0C/min -> 100 0C 2.7 0C/min -> 140 0C 2.4 0C/min -> 180 0C 6 0C/min -> 250 0C50 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
I 857.858.860.857.857.
ReferenceMallia, Escher, et al., 2007Meekijjaroenroj, Bessière, et al., 2007Moriarity, Bansal, et al., 2007Proffit, 2007Proffit, 2007
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5 MSHP-5 MSHP-5MSPolydimethyl siloxane5 % Phenyl methyl siloxane
Column length (m) 30.30.30. 30.
Carrier gas HeliumHeliumHe  
Substrate      
Column diameter (mm) 0.250.250.25 0.25
Phase thickness (μm)  0.25  0.75
Program 40 0C (10 min) 3 oC/min -> 200 0C 2 0C/min -> 220 0Cnot specified40C(10min) => 3C/min => 200C => 2C/min => 220Cnot specified50C(1min) => 5C/min => 100C => 10C/min => 190C => 30C/min => 250C(1min)
I 856.857.864.856.855.
ReferenceSetzer, Stokes, et al., 2007Sharififar, Mozaffarian, et al., 2007Takaku, Haber, et al., 2007Werka, Boehme, et al., 2007Beaulieu J.C. and Lea J.M., 2006
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase Ultra-2HP-5HP-5Methyl SiliconeHP-5 MS
Column length (m) 25.30.30. 30.
Carrier gas H2HeHe Helium
Substrate      
Column diameter (mm) 0.250.250.25 0.25
Phase thickness (μm) 0.330.250.25 0.25
Program not specified60C(4min) => 1C/min => 64C => 2.5C/min => 155C => 5C/min => 250C60C(4min) => 1C/min => 64C => 2.5C/min => 155C => 5C/min => 250Cnot specified40 0C (10 min) 3 0C/min -> 200 0C 2 0C/min -> 220 0C
I 857.852.852.850.854.
ReferenceCeva-Antunes, Bizzo, et al., 2006Jordan, Martinez, et al., 2006Jordan, Martinez, et al., 2006Kou, Zhang, et al., 2006Schmidt, Noletto, et al., 2006
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5 MSHP-1HP-5CP-Sil5 CB MSDB-5
Column length (m) 30.50.50.50.30.
Carrier gas HeliumHeHe He
Substrate      
Column diameter (mm) 0.250.320.20.320.25
Phase thickness (μm) 0.250.520.51.20.25
Program 40 0C (10 min) 3 0C/min -> 200 0C 2 0C/min -> 220 0C40C => 2C/min => 130C => 4C/min => 250C (25min)40C(1min) => 5C/min => 210C => 20C/min => 250C(8min)36C(2min) => 20C/min => 85C => 1C/min => 145C => 3C/min => 250C(30min)35C => 4C/min => 180C => 10C/min => 280C
I 876.843.855.836.857.
ReferenceSchmidt, Noletto, et al., 2006Senger-Emonnot, Rochard, et al., 2006Himanen, Vuorinen, et al., 2005Iraqi, Vermeulen, et al., 2005de Andrade, Bezerra, et al., 2004
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase MFE-73Methyl SiliconeHP-5SE-30HP-5
Column length (m)   30. 30.
Carrier gas   He  
Substrate      
Column diameter (mm)   0.25 0.25
Phase thickness (μm)   0.25 0.25
Program not specifiednot specified60C(4min) => 1C/min => 64C => 2.5C/min => 155C => 5C/min => 250Cnot specified40C(6min) => 2.5C/min => 150C => 90C/min => 250C
I 852.850.852.847.852.
ReferenceEscudero, Gogorza, et al., 2004Fu and Wang, 2004Sotomayor, Martínez, et al., 2004Vinogradov, 2004Jordán, Margaría, et al., 2003
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5HP-5HP-5CP Sil 8 CBMFE-73
Column length (m) 30.30.30.60.30.
Carrier gas    HeH2
Substrate      
Column diameter (mm) 0.250.250.250.320.32
Phase thickness (μm) 0.250.250.250.250.1
Program 40C(6min) => 2.5C/min => 150C => 90C/min => 250Cnot specifiednot specified40C(2min) => 40C/min => 60C(2min) => 6C/min => 250C(15min)40C(5min) => 2C/min => 120C => 10C/min => 210C(30min)
I 852.852.841.865.860.
ReferenceJordán, Margaría, et al., 2003Jordán, Goodner, et al., 2002Jordán, Goodner, et al., 2002Landy, Boucon, et al., 2002Aznar, López, et al., 2001
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase MFE-73HP-5OV-101DB-5CP Sil 5 CB
Column length (m) 30.30.50.30.25.
Carrier gas H2 N2He 
Substrate      
Column diameter (mm) 0.320.250.250.250.39
Phase thickness (μm) 0.10.25 0.25 
Program 40 C (5min) => 2C/min => 120C => 10 C/min => 210 C (30min)40C (6min) => 2.5C/min => 150C => 90C/min => 250Cnot specified40C => 2C/min => 60C => 4C/min => 260Cnot specified
I 860.869.836.856.840.
ReferenceFerreira, Aznar, et al., 2001Jordán, Shaw, et al., 2001Yang, 2001Andrade, Maia, et al., 2000Weyerstahl, Marschall, et al., 1999
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase SF-96RTX-5SE-54DB-5DB-5
Column length (m) 40.30.30.30.30.
Carrier gas  He   
Substrate      
Column diameter (mm) 0.280.530.320.320.25
Phase thickness (μm)  1.50.250.25 
Program 75C => 3C/min => 190C(25min) => 3C/min => 210C35 0C (2 min) 40 0C/min -> 60 0C (1 min) 6 0C/min -> 230 0C35 0C (2 min) 40 0C/min -> 50 0C (1 min) 6 0C/min -> 230 0C35C (1min) => 40C/min => 60C (1min) => 6C/min => 250C (10min)not specified
I 839.858.858.858.862.
ReferenceKawasaki, Matsui, et al., 1998Masanetz and Grosch, 1998Reiners and Grosch, 1998Guth, 1997Garneau, Bouhajib, et al., 1994
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5DB-5DB-5DB-1DB-1
Column length (m) 30.30.30.60.60.
Carrier gas      
Substrate      
Column diameter (mm) 0.250.320.320.320.32
Phase thickness (μm)  1.1.  
Program not specified0C(5min) => 60C/min => 60C (5min) => 4C/min => 250C (5min)0C(5min) => 60C/min => 60C (5min) => 4C/min => 250C (5min)not specifiednot specified
I 861.822.831.834.834.
ReferenceJean, Garneau, et al., 1993Storer, Elmore, et al., 1993Storer, Elmore, et al., 1993Binder, Flath, et al., 1989Binder and Flath, 1989
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-1DB-1DB-1OV-101SF96+Igepal
Column length (m)  30.30.60.152.
Carrier gas  H2H2  
Substrate      
Column diameter (mm)  0.250.250.250.76
Phase thickness (μm)  0.250.25  
Program not specified30C (2min) => 2C/min => 150C => 4C/min => 250C30C (2min) => 2C/min => 150C => 4C/min => 250Cnot specified25C(1min) => 5C/min => 50C (4min) => 1.25C/min => 180C
I 847.834.836.847.877.
ReferenceMacLeod and Snyder, 1988Takeoka, Flath, et al., 1988Takeoka, Flath, et al., 1988Shibamoto, 1987Flath, Altieri, et al., 1984
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillary
Active phase SF-96SF-96
Column length (m)   
Carrier gas HeHe
Substrate   
Column diameter (mm)   
Phase thickness (μm)   
Program not specifiednot specified
I 849.853.
ReferenceFagan, Kepner, et al., 1982Fagan, Kepner, et al., 1982
Comment MSDC-RI MSDC-RI

References

Go To: Top, Normal alkane RI, non-polar column, custom temperature program, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Robinson, Adams, et al., 2012
Robinson, A.L.; Adams, D.O.; Boss, P.K.; Heymann, H.; Solomon, P.S.; Trengove, R.D., Influence of geographic origine on the sensory characteristics and wine composition of Vitus viniferas cv. Cabernet Sauvignon wines from Australia (Supplemental data), Am. J. Enol. Vitic., 2012, 64, 4, 467-476, https://doi.org/10.5344/ajev.2012.12023 . [all data]

VOC BinBase, 2012
VOC BinBase, The volatile compound BinBase (VOC BinBase), 2012, retrieved from http://fiehnlab.ucdavis.edu/projects/VocBinBase and http://binbase.sourceforge.net. [all data]

de Freitas, Garruti, et al., 2011
de Freitas, V.M.; Garruti, D. dosS.; Souza Neto, M.A.; Facundo, H.V. daV.; Correia, J.M., Stability of volatile profile and sensory properties of passion fruit during storage in glass bottles, Ciencia e Tecnologia de Alimentos, Campinas, 2011, 31, 2, 349-354, https://doi.org/10.1590/S0101-20612011000200011 . [all data]

Laribi, Kouki, et al., 2011
Laribi, B.; Kouki, K.; Sahli, A.; Mougou, A.; Marzouk, B., Essential oil fatty acids composition of a Tunisian caraway (Carum carvi L.) seed ecotype cultivated under water deficit, Adv. Environ. Biol., 2011, 1-15, retrieved from http://www.thefreelibrary.com//print/PrintArticle.aspx?id=253057768. [all data]

Skogerson, Wohlgemuth, et al., 2011
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Takeoka, Hobbs, et al., 2010
Takeoka, G.R.; Hobbs, C.; Byeoung-Soo, P., Volatile constituents of the aerial parts of Salvia apiana Jepson, J. Essential Oil. Res., 2010, 22, 3, 241-244, https://doi.org/10.1080/10412905.2010.9700314 . [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, J. Chem. Ecol., 2009, 35, 11, 1349-1362, https://doi.org/10.1007/s10886-009-9718-1 . [all data]

Leela, Vipin, et al., 2009
Leela, N.K.; Vipin, T.M.; Shafeekh, K.M.; Priyanka, V.; Rema, J., Chemical composition of essential oils from aerial parts of Cinnamomum malabatrum (Burman f.) Bercht Presl., Flavor Fragr. J., 2009, 24, 1, 13-16, https://doi.org/10.1002/ffj.1910 . [all data]

Maggi, Bilek, et al., 2009
Maggi, F.; Bilek, T.; Lucarini, D.; Papa, F.; Sagratini, G.; Vittori, S., Melittis melissophyllum L. subsp. melissophylum (Lamiaceae) from central Italy: A new source of a mushrrom-like flavour, Food Chem., 2009, 113, 1, 216-221, https://doi.org/10.1016/j.foodchem.2008.07.066 . [all data]

Breme, Langle, et al., 2008
Breme, K.; Langle, S.; Fernandez, X.; Meierhenrich, U.J.; Brevard, H.; Joulain, D., Character impact odorants from Brassicaceae by aroma extracts dilution analysis (AEDA): Brassica cretica and Brassica insularis, Flavour Fragr. J., 2008, 24, 2, 88-93, https://doi.org/10.1002/ffj.1912 . [all data]

Kannaste, Vongvanich, et al., 2008
Kannaste, A.; Vongvanich, N.; Borg-Karlson, A.-K., Infestation by a Nalepella species induces emissions of alpha- and beta-farnesenes, (-)-linalool and aromatic compounds in Norway spruce clones of different susceptibility to the large pine weevil, Anthropod-Plant Interactions, 2008, 2, 1, 31-41, https://doi.org/10.1007/s11829-008-9029-4 . [all data]

Nogueira, Marcelo-Curto, et al., 2008
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Profitt, Schatz, et al., 2008
Profitt, M.; Schatz, B.; Bessiere, J.-M.; Chen, C.; Soler, C.; Hossaert-McKey, M., Signalling receptivity: comparison of the emission of volatile compounds by figs of Ficus hispida before, during and after the phase of receptivity to pollinators, Symbiosis, 2008, 45, 1-10. [all data]

Zhao, Li, et al., 2008
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Zhu, Li, et al., 2008
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Barra, Baldovini, et al., 2007
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Bosch-Fuste, Riu-Aumatell, et al., 2007
Bosch-Fuste, J.; Riu-Aumatell, M.; Guadayol, J.M.; Caixach, J.; Lopez-Tamames, E.; Buxaderas, S., Volatile profiles of sparkling wines obtained by three extraction methods and gas chromatography-mass spectrometry (GC-MS) analysis, Food Chem., 2007, 105, 1, 428-435, https://doi.org/10.1016/j.foodchem.2006.12.053 . [all data]

Chokeprasert P., Charles A.L., et al., 2007
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Cole, Haber, et al., 2007
Cole, R.A.; Haber, W.A.; Setzer, W.N., Chemical composition of essential oils of seven species of Eugenia from Monteverde, Costa Rica, Biochem. Syst. Ecol., 2007, 35, 12, 877-886, https://doi.org/10.1016/j.bse.2007.06.013 . [all data]

Dou, Li, et al., 2007
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Mallia, Escher, et al., 2007
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Meekijjaroenroj, Bessière, et al., 2007
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Moriarity, Bansal, et al., 2007
Moriarity, D.M.; Bansal, A.; Cole, R.A.; Takaku, S.; Haber, W.A.; Setzer, W.N., Selective cytotoxic activities of leaf essential oils from Monteverde Costa Rica, Natural Product Communications, 2007, 2, 12, 1263-1268. [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]

Setzer, Stokes, et al., 2007
Setzer, W.N.; Stokes, S.L.; Penton, A.F.; Takaku, S.; Haber, W.A.; Hansell, E.; Caffrey, C.R.; McKerrow, J.H., Cruzain inhibitory activity of leaf essential oils of neotropical Lauraceae and essential oil components, Natural Product Communications, 2007, 2, 12, 1203-1210. [all data]

Sharififar, Mozaffarian, et al., 2007
Sharififar, F.; Mozaffarian, V.; Moradkhani, S., Comparison of antioxidant and free radical scavenging activities of the essential oils from flowers and fruits of Otostegia persica Boiss., Pakistan J. Biol. Sci., 2007, 10, 21, 3895-3899, https://doi.org/10.3923/pjbs.2007.3895.3899 . [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]

Werka, Boehme, et al., 2007
Werka, J.S.; Boehme, A.K.; Setzer, W.N., Biological activities of essential oils from Monteverde, Costa Rica, Natural Product Communications, 2007, 2, 12, 1215-1219. [all data]

Beaulieu J.C. and Lea J.M., 2006
Beaulieu J.C.; Lea J.M., Characterization and semiquantitative analysis of volatiles in seedless watermelon varieties using solid-phase microextraction, J. Agric. Food Chem., 2006, 54, 20, 7789-7793, https://doi.org/10.1021/jf060663l . [all data]

Ceva-Antunes, Bizzo, et al., 2006
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Notes

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