Butanal, 2-methyl-

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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 HP-5DB-5DB-5 MSCP-Sil 5 CbSE-54
Column length (m) 30.30.30.50. 
Carrier gas HeliumHydrogenHeliumNitrogenHelium
Substrate      
Column diameter (mm) 0.250.320.250.32 
Phase thickness (μm) 0.250.500.251.20 
Program 30 0C (1 min) 2 0C/min -> 100 0C (5 min) 5 0C/min -> 170 0C40 0C (5 min) 4 0C/min -> 100 0C 6 0C/min -> 220 0C (20 min)not specified40 0C 20 0C/min -> 85 0C 1 0C/min -> 145 0C 3 0C/min -> 250 0C (30 min)not specified
I 681.663.664.661.651.
ReferenceFang, Pu, et al., 2012San-Juan, Petka, et al., 2010Su, Wang, et al., 2009Collin, Nizet, et al., 2008Frauendorfer and Schieberle, 2008
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase SLB-5MSHP-5HP-1HP-5SE-54
Column length (m) 10.50.50.50.30.
Carrier gas HeliumHeliumHe  
Substrate      
Column diameter (mm) 0.180.320.20.320.32
Phase thickness (μm) 0.181.050.331.050.25
Program not specified40 0C (10 min) 5 0C/min -> 200 0C 15 0C/min -> 250 0C (10 min)40C(2min) => 2C/min => 200C => 15C/min => 250C (30min)35 0C (10 min) 10 0C/min -> 150 0C 20 0C/min -> 250 0C (10 min)35C(2min) => 40C/min => 60C(2min) => 6C/min => 180C => 10C/min => 230C(10min)
I 645.641.635.668.663.
ReferenceRisticevic, Carasek, et al., 2008Ventanas, Estevez, et al., 2008Barra, Baldovini, et al., 2007Carrapiso and Garsia, 2007Lasekan, Buettner, et al., 2007
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5MSHP-5BPX-5DB-1BPX-5
Column length (m)   60.60.60.
Carrier gas  HeHeHeHe
Substrate      
Column diameter (mm)   0.320.320.25
Phase thickness (μm)   1.0.250.25
Program not specified50C => 3C/min => 200C(10min) => 10C/min => 290C(10min)40C(4min) => 2C/min => 90C => 4C/min => 130C => 8C/min => 250C33C(5min) => 2C/min => 50c => 5C/min => 225C40C(5min) => 5C/min => 100C => 20C/min => 280C (5min)
I 645.681.682.631.671.
ReferenceMallia, Escher, et al., 2007Splivallo, Bossi, et al., 2007van Ruth, Floris, et al., 2006Cramer, Mattinson, et al., 2005Duflos, Moine, et al., 2005
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase CP-Sil5 CB MSHP-5CP Sil 5 CBHP-5DB-5
Column length (m) 50.60.50.50.50.
Carrier gas      
Substrate      
Column diameter (mm) 0.320.320.320.320.32
Phase thickness (μm) 1.21.1.21.051.05
Program 36C(2min) => 20C/min => 85C => 1C/min => 145C => 3C/min => 250C(30min)not specified36C => 20C/min => 85C => 1C/min => 145C => 3C/min => 250C(30min)40C(10min) => 5C/min => 200C => 20C/min => 250C(5min)40C(10min) => 5C/min => 200C => 20C/min => 250C (5min)
I 661.657.668.660.660.
ReferenceIraqi, Vermeulen, et al., 2005Thierry, Maillard, et al., 2005Counet, Ouwerx, et al., 2004Garcia-Estaban, Ansorena, et al., 2004Garcia-Estaban, Ansorena, et al., 2004, 2
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-1BPX-5SE-30Polydimethyl siloxaneRTX-5 MS
Column length (m)  60.  60.
Carrier gas  He  He
Substrate      
Column diameter (mm)  0.32  0.25
Phase thickness (μm)  1.  0.5
Program not specified40C (4min) => 2C/min => 90C => 4C/min => 130C => 8C/min => 250 C (10min)not specifiednot specified35C (3min) => 10C/min => 50C => 4C/min => 200C => 50C/min => 250C (10min)
I 645.675.665.645.666.
ReferenceJunkes, Amboni, et al., 2004Machiels, Istasse, et al., 2004Vinogradov, 2004Junkes, Castanho, et al., 2003Machiels and Istasse, 2003
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase BPX-5BPX-5DB-5MSDB-5CP Sil 5 CB
Column length (m) 60.60.30.30.50.
Carrier gas HeHe   
Substrate      
Column diameter (mm) 0.320.320.250.530.32
Phase thickness (μm) 1.1.1.1.51.2
Program 40C (4min) => 2C/min => 90C => 4C/min => 130C => 8C/min => 250 C (10min)40C (4min) => 2C/min => 90C => 4C/min => 130C => 8C/min => 250 C (10min)50C => 3C/min => 160C => 6C/min => 250C => 25C/min => 325C-5C(1min) => 4C/min => 50C => 6C/min => 120C => 8C/min => 250C(2min)36C => 20C/min => 85C => 1C/min => 145C=3C/min => 250C(30min)
I 664.654.662.665.643.
ReferenceMachiels, van Ruth, et al., 2003Machiels, van Ruth, et al., 2003Young, Lane, et al., 2003Bücking and Steinhart, 2002Counet, Callemien, et al., 2002
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase CP Sil 5 CBMethyl phenyl siloxane (not specified)DB-5CP Sil 8 CBDB-5 MS
Column length (m) 50.  60.30.
Carrier gas     Helium
Substrate      
Column diameter (mm) 0.32  0.250.25
Phase thickness (μm) 1.2  0.251.0
Program 36C => 20C/min => 85C => 1C/min => 145C=3C/min => 250C(30min)not specifiednot specifiednot specifiednot specified
I 643.660.653.672.674.
ReferenceCounet, Callemien, et al., 2002Poligne, Collignan, et al., 2002Staples E.S., 2002Duckham, Dodson, et al., 2001Luo and Agnew, 2001
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase Polydimethyl siloxaneRTX-5DB-5SE-54HP-5
Column length (m)   30.30.50.
Carrier gas   He He
Substrate      
Column diameter (mm)   0.320.320.32
Phase thickness (μm)   0.250.250.52
Program not specifiednot specified35C(1min) => 40C/min => 60C (1min) => 6C/min => 230C35 0C (2 min) 40 0C/min -> 50 0C (1 min) 6 0C/min -> 230 0C35 0C 10 0C/min -> 200 0C (20 min) 5 0C/min -> 230 0C (50 min)
I 663.666.664.650.677.
ReferenceSpanier, Shahidi, et al., 2001Masanetz, Guth, et al., 1998Matsui, Guth, et al., 1998Reiners and Grosch, 1998Timón, Ventanas, et al., 1998
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase SE-54SE-54DB-5DB-5Methyl Silicone
Column length (m) 25.30.50.50. 
Carrier gas HeHeHeHe 
Substrate      
Column diameter (mm) 0.320.320.320.32 
Phase thickness (μm) 0.25 0.250.25 
Program 35C(2min) => 50C/min => 60C(2min) => 4C/min => 230C35C => 40C/min => 60C (1min) => 6C/min => 250C40C(10min) => 3C/min => 95C => 10C/min => 270C(10min)40C (10min) => 3C/min => 95C => 10C/min => 270C (10min)not specified
I 662.660.635.665.639.
ReferenceZehentbauer and Grosch, 1998Lizárraga-Guerra, Guth, et al., 1997Mateo, Aguirrezábal, et al., 1997Mateo and Zumalacárregui, 1996Misharina, 1995
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase RSL-150DB-1DB-1CP Sil 8 CBmethyl silicone oil with 5% Igepal
Column length (m) 60.60.60.40.150.
Carrier gas He  He 
Substrate      
Column diameter (mm) 0.320.250.250.250.75
Phase thickness (μm) 0.250.250.250.25 
Program 30c (1.5min) => 20C/min => 55C => 6C/min => 200C(10min)not specifiednot specified30 0C (1 min) 15 0C/min -> 45 0C 3 0C/min -> 120 0Cnot specified
I 625.634.637.663.640.
ReferenceBuchbauer, Nikiforov, et al., 1994Kawai, Ishida, et al., 1991Kawai, Ishida, et al., 1991Weller and Wolf, 1989Schultz, Flath, et al., 1988
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillary
Active phase methyl silicone oil with 5% IgepalSF96+Igepal
Column length (m) 150.152.
Carrier gas   
Substrate   
Column diameter (mm) 0.750.76
Phase thickness (μm)   
Program not specified25C(1min) => 5C/min => 50C (4min) => 1.25C/min => 180C
I 643.646.
ReferenceSchultz, Flath, et al., 1988Flath, Altieri, et al., 1984
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.

Fang, Pu, et al., 2012
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Collin, Nizet, et al., 2008
Collin, S.; Nizet, S.; Muls, S.; Iraqi, R.; Bouseta, A., Characterization of odor-active compounds in extracts obtained by simultaneous extraction/distillation from Moroccan black olives, J. Agric. Food Chem., 2008, 56, 9, 3273-3278, https://doi.org/10.1021/jf073488x . [all data]

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Frauendorfer, F.; Schieberle, P., Changes in key aroma compounds of criollo cocoa beans during roasting, J. Agric. Food Chem., 2008, 56, 21, 10244-10251, https://doi.org/10.1021/jf802098f . [all data]

Risticevic, Carasek, et al., 2008
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Ventanas, Estevez, et al., 2008
Ventanas, S.; Estevez, M.; Andres, A.I.; Ruiz, J., Analysis of volatile compounds of Iberian dry-cured loins with different intramuscular fat contents using SPME-DED, Meat Sci., 2008, 79, 1, 172-180, https://doi.org/10.1016/j.meatsci.2007.08.011 . [all data]

Barra, Baldovini, et al., 2007
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Carrapiso and Garsia, 2007
Carrapiso, A.I.; Garsia, C., Effect of sampling conditions on the odour-active compounds of iberian ham, Cienc. Technol. Aliment., 2007, 5, 4, 287-290, https://doi.org/10.1080/11358120709487703 . [all data]

Lasekan, Buettner, et al., 2007
Lasekan, O.; Buettner, A.; Christlbauer, M., Investigation of important odorants of palm wine (Elaeis guineensis), Food Chem., 2007, 105, 1, 15-23, https://doi.org/10.1016/j.foodchem.2006.12.052 . [all data]

Mallia, Escher, et al., 2007
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Splivallo, Bossi, et al., 2007
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van Ruth, Floris, et al., 2006
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Garcia-Estaban, Ansorena, et al., 2004, 2
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Lizárraga-Guerra, Guth, et al., 1997
Lizárraga-Guerra, R.; Guth, H.; López, M.G., Identification of the most potent odorants in huitlacoche (Ustilago maydis) and austern pilzen (Pleurotus sp.) by aroma extract dilution analysis and static head-space samples, J. Agric. Food Chem., 1997, 45, 4, 1329-1332, https://doi.org/10.1021/jf960650f . [all data]

Mateo, Aguirrezábal, et al., 1997
Mateo, J.; Aguirrezábal, M.; Domínguez, C.; Zumalacárregui, J.M., Volatile compounds in Spanish paprika, J. Food Comp. Anal., 1997, 10, 3, 225-232, https://doi.org/10.1006/jfca.1997.0535 . [all data]

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Misharina, 1995
Misharina, T.A., Sorption regularities of sulfur- and oxygen-containing compounds in chromatography and their application in identification of volatile organic compounds, Diss. degree of Dr. Sci. (Chemistry), 1995, 52. [all data]

Buchbauer, Nikiforov, et al., 1994
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Kawai, Ishida, et al., 1991
Kawai, T.; Ishida, Y.; Kakiuchi, H.; Ikeda, N.; Higashida, T.; Nakamura, S., Flavor components of dried squid, J. Agric. Food Chem., 1991, 39, 4, 770-777, https://doi.org/10.1021/jf00004a031 . [all data]

Weller and Wolf, 1989
Weller, J.-P.; Wolf, M., Massenspektroskopie und Headspace-GC, Beitr. Gerichtl. Med., 1989, 47, 525-532. [all data]

Schultz, Flath, et al., 1988
Schultz, T.H.; Flath, R.A.; Stern, D.J.; Mon, T.R.; Teranishi, R.; McKenna Kruse, S.; Butlder, B.; Howard, W.E., Coyote estrous urine volatiles, J. Chem. Ecol., 1988, 14, 2, 701-712, https://doi.org/10.1007/BF01013917 . [all data]

Flath, Altieri, et al., 1984
Flath, R.A.; Altieri, M.A.; Mon, T.R., Volatile constituents of Amaranthus retroflexus L., J. Agric. Food Chem., 1984, 32, 1, 92-94, https://doi.org/10.1021/jf00121a024 . [all data]


Notes

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