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Ethylbenzene

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Van Den Dool and Kratz 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 CapillaryCapillaryCapillaryCapillaryCapillary
Active phase SPB-5CP-Sil 8CB-MS5 % Phenyl methyl siloxaneHP-5HP-5MS
Column length (m) 60.0.30.50.30.
Carrier gas  HeHeHeHe
Substrate      
Column diameter (mm) 0.320.250.250.320.25
Phase thickness (mum) 1.0.251.1.050.25
Tstart (C) 40.40.40.35.60.
Tend (C) 230.280.250.220.250.
Heat rate (K/min) 3.4.7.8.4.
Initial hold (min) 2.2.10.15.2.
Final hold (min) 10.5.5.5.20.
I 866.862.879.871.868.
ReferenceEngel and Ratel, 2007Elmore, Cooper, et al., 2005Estevez, Ventanas, et al., 2005Insausti, Goñi, et al., 2005Pino, Mesa, et al., 2005
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5PONACP-Sil 8CB-MSSPB-5SPB-5
Column length (m) 25.50.60.30.30.
Carrier gas He  HeHe
Substrate      
Column diameter (mm) 0.20.20.250.250.25
Phase thickness (mum) 1.0.50.250.250.25
Tstart (C) 40.50.40.60.60.
Tend (C) 280. 280.250.250.
Heat rate (K/min) 5.2.4.4.4.
Initial hold (min)   2.2.2.
Final hold (min) 5. 5.20.20.
I 869.854.864.864.893.
ReferenceSolina, Baumgartner, et al., 2005Vendeuvre, Bertoncini, et al., 2005Hierro, de la Hoz, et al., 2004Pino, Marbot, et al., 2004Pino, Marbot, et al., 2004, 2
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase Petrocol DHCP Sil 5 CBDB-5DB-5DB-5
Column length (m) 50.60.30.30.30.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.250.320.250.250.25
Phase thickness (mum) 0.50.250.250.250.25
Tstart (C) 35.60.40.40.40.
Tend (C) 200.280.310.310.310.
Heat rate (K/min) 3.3.4.4.2.
Initial hold (min) 10.10. 5. 
Final hold (min) 10.60.   
I 850.8876.856.3855.5853.2
ReferenceCensullo, Jones, et al., 2003Pino, Almora, et al., 2003Song, Lai, et al., 2003Song, Lai, et al., 2003Song, Lai, et al., 2003
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5DB-5DB-1DB-5BPX-5
Column length (m) 30.30.30.30.50.
Carrier gas HeHeHeHe 
Substrate      
Column diameter (mm) 0.250.250.250.250.32
Phase thickness (mum) 0.250.250.251.0.5
Tstart (C) 40.40.40.50.60.
Tend (C) 310.310.325.200.250.
Heat rate (K/min) 4.6.3.2.54.
Initial hold (min)     5.
Final hold (min)     20.
I 856.3857.2839.8868.3872.
ReferenceSong, Lai, et al., 2003Song, Lai, et al., 2003Sun and Stremple, 2003Xu, van Stee, et al., 2003Bredie, Mottram, et al., 2002
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase CP Sil 8 CBHP-5BPX-5BPX-5BPX-5
Column length (m) 60.30.50.50.50.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.250.250.320.320.32
Phase thickness (mum) 0.250.250.250.250.25
Tstart (C) 40.40.35.35.35.
Tend (C) 250.180.250.250.250.
Heat rate (K/min) 4.3.4.4.4.
Initial hold (min) 8. 3.3.3.
Final hold (min) 10. 10.10.10.
I 860.857.865.866.865.
ReferenceOruna-Concha, Ames, et al., 2002Isidorov, Krajewska, et al., 2001Oruna-Concha, Duckham, et al., 2001Oruna-Concha, Duckham, et al., 2001Oruna-Concha, Duckham, et al., 2001
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase BPX-5CP Sil 5 CBOV-101CP Sil 8 CBCP Sil 8 CB
Column length (m) 50.50.80.50.25.
Carrier gas HeHeN2  
Substrate      
Column diameter (mm) 0.320.320.220.320.2
Phase thickness (mum) 0.250.4  0.25
Tstart (C) 35.60.30.60.40.
Tend (C) 250.280.130.220.200.
Heat rate (K/min) 4.3.1.4.2.
Initial hold (min) 3.10. 5.8.
Final hold (min) 10.60. 30. 
I 866.856.847.0855.849.
ReferenceOruna-Concha, Duckham, et al., 2001Pino and Marbot, 2001Yin, Liu, et al., 2001Chevance and Farmer, 1999Yassaa, Meklati, et al., 1999
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-1SE-54PONAPONAOV-1
Column length (m) 10.50.50.50. 
Carrier gas HeHe   
Substrate      
Column diameter (mm) 0.250.320.20.2 
Phase thickness (mum) 0.251.0.50.5 
Tstart (C) 30.40.35.35.35.
Tend (C) 225.220.220.220.300.
Heat rate (K/min) 2.10.1.1.8.
Initial hold (min)  2.0.50.5 
Final hold (min)  5.8.8. 
I 834.860.9836.1841.7846.1
ReferenceBeens, Tijssen, et al., 1998Kivi-Etelätalo, Kostiainen, et al., 1997Martos, Saraullo, et al., 1997Martos, Saraullo, et al., 1997Gautzsch and Zinn, 1996
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-1DB-5DB-5DB-5DB-5
Column length (m) 30.60.30.30.30.
Carrier gas   HeHeHe
Substrate      
Column diameter (mm) 0.250.330.250.250.25
Phase thickness (mum) 1.0.250.250.250.25
Tstart (C) -50.-50.40.40.40.
Tend (C) 180.180.310.310.310.
Heat rate (K/min) 6.6.2.4.6.
Initial hold (min)      
Final hold (min)      
I 846.4861.5853.2856.3857.2
ReferenceHelmig, Pollock, et al., 1996Helmig, Pollock, et al., 1996Lai and Song, 1995Lai and Song, 1995Lai and Song, 1995
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5DB-5Petrocol DHPetrocol DHDB-1
Column length (m) 30.30.100.100.60.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (mum) 0.250.250.50.51.0
Tstart (C) 40.40.30.30.40.
Tend (C) 310.310.220.220.260.
Heat rate (K/min) 4.4.1.1.2.
Initial hold (min)  5.  5.
Final hold (min)     60.
I 856.3855.5844.19844.47858.
ReferenceLai and Song, 1995Lai and Song, 1995Subramaniam, Bochniak, et al., 1994Subramaniam, Bochniak, et al., 1994Yu, Lin, et al., 1994
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase Ultra-1DB-1Petrocol DHPetrocol DHPetrocol DH
Column length (m)  30.100.100.100.
Carrier gas   HeHeHe
Substrate      
Column diameter (mm)  0.320.250.250.25
Phase thickness (mum)  1.50.50.50.5
Tstart (C) -40.40.30.30.30.
Tend (C) 230.280.220.220.220.
Heat rate (K/min) 4.8.1.1.1.
Initial hold (min)  4.   
Final hold (min)      
I 845.858.844.5844.74845.
ReferenceOlson, Sinkevitch, et al., 1992Peng, Hua, et al., 1992White, Douglas, et al., 1992White, Douglas, et al., 1992White, Hackett, et al., 1992
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type PackedCapillaryCapillaryCapillaryCapillary
Active phase SE-30DB-5SE-54SE-54SE-54
Column length (m) 1.515.25.25.25.
Carrier gas  HeHeHeHe
Substrate Chromosorb W AW (80-100 mesh)    
Column diameter (mm)  0.530.320.320.32
Phase thickness (mum)  1.50.150.150.15
Tstart (C) 60.40.40.40.40.
Tend (C) 280.90.280.280.280.
Heat rate (K/min) 5.4.5.5.5.
Initial hold (min)   1.1.1.
Final hold (min)   15.15.15.
I 864.855.848.3856.2848.3
ReferenceFischer and Kusch, 1990Morinaga, Hara, et al., 1990Shapi and Hesso, 1990Shapi and Hesso, 1990Shapi and Hesso, 1990
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase SE-54SE-54Ultra-1Ultra-1HP-1
Column length (m) 25.25.50.50.25.
Carrier gas HeHeHeHeN2
Substrate      
Column diameter (mm) 0.320.320.220.20.2
Phase thickness (mum) 0.150.150.330.33 
Tstart (C) 40.40.0.0.30.
Tend (C) 280.280.240.240. 
Heat rate (K/min) 5.5.2.2.10.
Initial hold (min) 1.1.   
Final hold (min) 15.15.   
I 848.3856.2845.17845.49848.7
ReferenceShapi and Hesso, 1990Shapi and Hesso, 1990Steward and Pitzer, 1988Steward and Pitzer, 1988Bangjie, Xijian, et al., 1987
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-1HP-1Ultra-1Ultra-1Ultra-1
Column length (m) 25.25.50.50.50.
Carrier gas N2N2HeHeHe
Substrate      
Column diameter (mm) 0.20.20.220.220.22
Phase thickness (mum)   0.330.330.33
Tstart (C) 30.30.-30.-30.-30.
Tend (C)   240.240.240.
Heat rate (K/min) 2.5.1.2.3.
Initial hold (min)  5.   
Final hold (min)      
I 844.8844.6841.26844.05845.90
ReferenceBangjie, Xijian, et al., 1987Bangjie, Xijian, et al., 1987Haynes and Pitzer, 1985Haynes and Pitzer, 1985Haynes and Pitzer, 1985
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryPacked
Active phase Ultra-2Ultra-2Ultra-2OV-101OV-101
Column length (m) 50.50.50.108.2.5
Carrier gas HeHeHe  
Substrate     Gas-Chrom Q
Column diameter (mm) 0.220.220.220.25 
Phase thickness (mum) 0.330.330.330.2 
Tstart (C) -30.-30.-30.35.50.
Tend (C) 240.240.240.200.220.
Heat rate (K/min) 1.2.3.1.2.
Initial hold (min)      
Final hold (min)      
I 857.33860.40862.45843.877.
ReferenceHaynes and Pitzer, 1985Haynes and Pitzer, 1985Haynes and Pitzer, 1985Hayes and Pitzer, 1981Nixon, Wong, et al., 1979
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI

References

Go To: Top, Van Den Dool and Kratz 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.

Engel and Ratel, 2007
Engel, E.; Ratel, J., Correction of the data generated by mass spectrometry analyses of biological tissues: Application to food authentication, J. Chromatogr. A, 2007, 1154, 1-2, 331-341, https://doi.org/10.1016/j.chroma.2007.02.012 . [all data]

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Pino, Mesa, et al., 2005
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White, Hackett, et al., 1992
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Fischer and Kusch, 1990
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Morinaga, Hara, et al., 1990
Morinaga, M.; Hara, K.; Kageura, M.; Heida, Y.; Takamoto, M.; Kashimura, S., A simple, rapid and simultaneous analysis of complex volatile hydrocarbon mixtures in blood using gas chromatography/mass spectrometry with a wide-bore capillary column, Z. Rechtsmed., 1990, 103, 8, 567-572, https://doi.org/10.1007/BF01261420 . [all data]

Shapi and Hesso, 1990
Shapi, M.M.; Hesso, A., Thermal decomposition of polystyrene volatile compounds from large-scale pyrolysis, J. Anal. Appl. Pyrolysis, 1990, 18, 2, 143-161, https://doi.org/10.1016/0165-2370(90)80004-8 . [all data]

Steward and Pitzer, 1988
Steward, E.M.; Pitzer, E.W., Gas Chromatographic Analyses of Complex Hydrocarbon Mixtures Void of n-Paraffin Retention Index Markers Using Joint Mass Spectral and Retention Index Libraries, J. Chromatogr. Sci., 1988, 26, 5, 218-222, https://doi.org/10.1093/chromsci/26.5.218 . [all data]

Bangjie, Xijian, et al., 1987
Bangjie, C.; Xijian, G.; Shaoyi, P., Calculation of retention indices in temperature-programmed gas chromatography, Chromatographia, 1987, 23, 12, 888-892, https://doi.org/10.1007/BF02261466 . [all data]

Haynes and Pitzer, 1985
Haynes, P.C., Jr.; Pitzer, E.W., Disengaging solutes in shale- and petroleum-derived jet fuels by altering GC programmed temperature rates, J. Hi. Res. Chromatogr. Chromatogr. Comm., 1985, 8, 5, 230-242, https://doi.org/10.1002/jhrc.1240080504 . [all data]

Hayes and Pitzer, 1981
Hayes, P.C., Jr.; Pitzer, E.W., Kovats indices as a tool in characterizing hydrocarbon fuels in temperature programmed glass capillary gas chromatography. Part 1. Qualitative identification, Inhouse rpt. for Air Force Wright Aeronautical Labs., Air Force Wright Aeronautical Labs., Wright-Patterson AFB, Ohio, 1981, 75. [all data]

Nixon, Wong, et al., 1979
Nixon, L.N.; Wong, E.; Johnson, C.B.; Birch, E.J., Nonacidic constituents of volatiles from cooked mutton, J. Agric. Food Chem., 1979, 27, 2, 355-359, https://doi.org/10.1021/jf60222a044 . [all data]


Notes

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