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Isobutyl acetate

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Condensed phase thermochemistry data

Go To: Top, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Mass spectrum (electron ionization), Gas Chromatography, NIST Free Links, References, Notes

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

Data compiled as indicated in comments:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Deltacliquid-3534.kJ/molCcbSchjanberg, 1935Corresponding «DELTA»fliquid = -541.8 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS

Constant pressure heat capacity of liquid

Cp,liquid (J/mol*K) Temperature (K) Reference Comment
240.2290.Kurnakov and Voskresenskaya, 1936DH

Phase change data

Go To: Top, Condensed phase thermochemistry data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Mass spectrum (electron ionization), Gas Chromatography, NIST Free Links, References, Notes

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

Data compiled as indicated in comments:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Kenneth Kroenlein director
BS - Robert L. Brown and Stephen E. Stein
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos

Quantity Value Units Method Reference Comment
Tboil390. ± 1.KAVGN/AAverage of 26 out of 27 values; Individual data points
Quantity Value Units Method Reference Comment
Tfus176.05KN/AAnonymous, 1968TRC
Tfus176.1KN/AAnonymous, 1956Uncertainty assigned by TRC = 0.6 K; TRC
Tfus240.15KN/ATimmermans, 1952Uncertainty assigned by TRC = 0.5 K; TRC
Quantity Value Units Method Reference Comment
Tc560.8KN/AQuadri and Kudchadker, 1991Uncertainty assigned by TRC = 0.6 K; TRC
Tc561.5KN/ANadezhdin, 1887Uncertainty assigned by TRC = 2. K; TRC
Tc569.0KN/APawlewski, 1882Uncertainty assigned by TRC = 5. K; TRC
Quantity Value Units Method Reference Comment
Pc30.10barN/AQuadri and Kudchadker, 1991Uncertainty assigned by TRC = 0.20 bar; TRC
Pc31.80barN/ANadezhdin, 1887Uncertainty assigned by TRC = 0.6079 bar; TRC
Quantity Value Units Method Reference Comment
rhoc2.42mol/lN/ANadezhdin, 1887Uncertainty assigned by TRC = 0.07 mol/l; TRC
Quantity Value Units Method Reference Comment
Deltavap35.9 ± 0.04kJ/molVMathews, 1926ALS

Enthalpy of vaporization

DeltavapH (kJ/mol) Temperature (K) Method Reference Comment
39.9323.N/AMontón, Muñoz, et al., 2005Based on data from 308. - 391. K.; AC
39.2340.N/ABurguet, Montón, et al., 1996Based on data from 325. - 393. K.; AC
39.8267.AStephenson and Malanowski, 1987Based on data from 252. - 391. K. See also Stull, 1947.; AC

Antoine Equation Parameters

log10(P) = A − (B / (T + C))
    P = vapor pressure (bar)
    T = temperature (K)

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Temperature (K) A B C Reference Comment
252.0 - 391.4.536761625.875-32.494Stull, 1947Coefficents calculated by NIST from author's data.

In addition to the Thermodynamics Research Center (TRC) data available from this site, much more physical and chemical property data is available from the following TRC products:


Reaction thermochemistry data

Go To: Top, Condensed phase thermochemistry data, Phase change data, Henry's Law data, Gas phase ion energetics data, Mass spectrum (electron ionization), Gas Chromatography, NIST Free Links, 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

Ketene + 1-Propanol, 2-methyl- = Isobutyl acetate

By formula: C2H2O + C4H10O = C6H12O2

Quantity Value Units Method Reference Comment
Deltar-143.8kJ/molCmRice and Greenberg, 1934liquid phase

Henry's Law data

Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, Mass spectrum (electron ionization), Gas Chromatography, NIST Free Links, 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: Rolf Sander

Henry's Law constant (water solution)

kH(T) = H exp(d(ln(kH))/d(1/T) ((1/T) - 1/(298.15 K)))
H = Henry's law constant for solubility in water at 298.15 K (mol/kg*bar)
d(ln(kH))/d(1/T) = Temperature dependence constant (K)

H (mol/kg*bar) d(ln(kH))/d(1/T) (K) Method Reference
2.2 VN/A

Gas phase ion energetics data

Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Mass spectrum (electron ionization), Gas Chromatography, NIST Free Links, 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: Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

Ionization energy determinations

IE (eV) Method Reference
9.97PIWatanabe, Nakayama, et al., 1962

Mass spectrum (electron ionization)

Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Gas Chromatography, NIST Free Links, 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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Mass 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 NIST Mass Spectrometry Data Center
NIST MS number 352254

All mass spectra in this site (plus many more) are available from the NIST/EPA/NIH Mass Spectral Library. Please see the following for information about the library and its accompanying search program.


Gas Chromatography

Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Mass spectrum (electron ionization), NIST Free Links, 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, isothermal

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Column type Active phase Temperature (C) I Reference Comment
CapillaryOV-1333.757.7Hu, Lu, et al., 2006 
CapillaryHP-10160.758.98Garay, 200050. m/0.2 mm/0.2 «mu»m, H2
CapillarySPB-160.757.Castello, Vezzani, et al., 1991N2; Column length: 60. m; Column diameter: 0.75 mm
PackedSE-30150.755.Tiess, 1984Ar, Gas Chrom Q (80-100 mesh); Column length: 3. m
CapillaryOV-10180.757.2Komárek, Hornová, et al., 1982N2; Column length: 15. m; Column diameter: 0.22 mm
PackedSE-30150.750.Ashes and Haken, 1974Celaton (62-72 mesh); Column length: 3.7 m
PackedSE-30100.768.Chastrette, Heintz, et al., 1974N2, Chromosorb W AW (60-80 mesh); Column length: 3. m
PackedSE-30100.758.Zarazir, Chovin, et al., 1970Chromosorb W; Column length: 2. m
PackedSE-30150.750.Germaine and Haken, 1969Celite 560; Column length: 3.7 m

Kovats' RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryCBP-1762.Shimadzu, 200325. m/0.2 mm/0.25 «mu»m, He, 50. C @ 5. min, 4. K/min; Tend: 200. C
CapillaryDB-1764.Takeoka, Buttery, et al., 199260. m/0.32 mm/0.25 «mu»m, He, 30. C @ 4. min, 2. K/min; Tend: 210. C
CapillaryDB-1763.Takeoka, Buttery, et al., 199260. m/0.32 mm/0.25 «mu»m, He, 30. C @ 4. min, 2. K/min; Tend: 210. C
CapillaryDB-1764.Takeoka, Buttery, et al., 199260. m/0.32 mm/0.25 «mu»m, He, 30. C @ 4. min, 2. K/min; Tend: 210. C
CapillaryDB-1763.Takeoka, Buttery, et al., 199260. m/0.32 mm/0.25 «mu»m, He, 30. C @ 4. min, 2. K/min; Tend: 210. C
CapillaryOV-101758.Ohnishi and Shibamoto, 19842. K/min; Column length: 50. m; Column diameter: 0.23 mm; Tstart: 80. C; Tend: 200. C
CapillaryOV-101760.Ohnishi and Shibamoto, 19842. K/min; Column length: 50. m; Column diameter: 0.23 mm; Tstart: 80. C; Tend: 200. C

Kovats' RI, non-polar column, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillaryDB-5MS764.Maia, Andrade, et al., 200030. m/0.25 mm/0.25 «mu»m, He; Program: 40C => 2C/min => 60C => 4C/min => 260C
CapillarySE-30750.Chretien and Dubois, 1978Program: not specified

Kovats' RI, polar column, isothermal

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Column type Active phase Temperature (C) I Reference Comment
CapillarySupelcowax-1060.1025.Castello, Vezzani, et al., 1991N2; Column length: 60. m; Column diameter: 0.75 mm
PackedCarbowax 20M100.1011.Chastrette, Heintz, et al., 1974Chromosorb WAW (60-80 mesh); Column length: 3. m
PackedCarbowax 20M100.1025.Zarazir, Chovin, et al., 1970Chromosorb W; Column length: 2. m

Kovats' RI, polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryCBP-201013.Shimadzu, 200325. m/0.2 mm/0.25 «mu»m, He, 50. C @ 5. min, 4. K/min; Tend: 200. C
CapillaryBP-201033.Wyllie and Leach, 199070. C @ 2. min, 4. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tend: 200. C
CapillaryDB-Wax1018.Umano, Shoji, et al., 1986N2, 60. C @ 10. min, 2. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tend: 200. C
CapillaryCarbowax 20M1020.Buttery, Seifert, et al., 1982He, 1. K/min; Column length: 150. m; Column diameter: 0.64 mm; Tstart: 50. C; Tend: 170. C

Van Den Dool and Kratz RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
Capillary5 % Phenyl methyl siloxane783.Zaikin, 201030. m/0.25 mm/0.25 «mu»m, 15. K/min, 270. C @ 15. min; Tstart: 60. C
CapillaryDB-5788.Fang and Qian, 200530. m/0.32 mm/1. «mu»m, N2, 40. C @ 2. min, 4. K/min, 230. C @ 10. min
CapillarySPB-5753.Rodríguez-Burruezo, Kollmannsberger, et al., 200430. m/0.53 mm/1.5 «mu»m, He, 5. K/min; Tstart: 100. C; Tend: 250. C
CapillaryPetrocol DH767.2Censullo, Jones, et al., 200350. m/0.25 mm/0.5 «mu»m, He, 35. C @ 10. min, 3. K/min, 200. C @ 10. min
CapillaryCP Sil 5 CB741.Pino and Marbot, 200150. m/0.32 mm/0.4 «mu»m, He, 60. C @ 10. min, 3. K/min, 280. C @ 60. min
CapillaryCP Sil 5 CB741.Pino, Marbot, et al., 200150. m/0.32 mm/0.4 «mu»m, He, 60. C @ 10. min, 3. K/min, 280. C @ 60. min
CapillaryHP-5781.Shalit, Katzir, et al., 2001He, 50. C @ 1. min, 4. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tend: 200. C
CapillaryDB-5779.Komárek, Richter, et al., 1998He, 5.5 K/min; Column length: 20. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 350. C
CapillaryDB-1756.Bartelt, 199730. m/0.32 mm/5. «mu»m, He, 35. C @ 1. min, 10. K/min; Tend: 270. C
CapillaryDB-1755.Lee, DeMilo, et al., 199760. m/0.248 mm/0.25 «mu»m, He, 5. K/min; Tstart: 50. C; Tend: 250. C
CapillaryDB-1755.Lee, DeMilo, et al., 199760. m/0.248 mm/0.25 «mu»m, He, 5. K/min; Tstart: 50. C; Tend: 250. C
CapillaryDB-1755.Lee, DeMilo, et al., 199760. m/0.248 mm/0.25 «mu»m, He, 5. K/min; Tstart: 50. C; Tend: 250. C
CapillaryDB-5770.Guichard and Souty, 1988H2, 30. C @ 5. min, 1.5 K/min; Column length: 0.32 m; Column diameter: 1. mm; Tend: 180. C
CapillaryOV-101745.3Wang and Sun, 198726. m/0.26 mm/0.3 «mu»m, 2. K/min; Tstart: 100. C; Tend: 240. C
CapillaryOV-101748.4Wang and Sun, 198726. m/0.26 mm/0.3 «mu»m, 2. K/min; Tstart: 60. C; Tend: 240. C
CapillaryOV-101749.7Wang and Sun, 198726. m/0.26 mm/0.3 «mu»m, 8. K/min; Tstart: 60. C; Tend: 240. C
CapillaryOV-101752.1Wang and Sun, 198721.5 m/0.27 mm/2. «mu»m, 6. K/min; Tstart: 60. C; Tend: 240. C
CapillaryOV-101749.8Wang and Sun, 198721.5 m/0.27 mm/0.14 «mu»m, 6. K/min; Tstart: 60. C; Tend: 240. C
CapillaryOV-101748.7Wang and Sun, 1987, 226.5 m/0.25 mm/0.14 «mu»m, 70. C @ 4.08 min, 9. K/min; Tend: 240. C
CapillaryOV-101754.45Wang, Zhong, et al., 198724. m/0.26 mm/0.5 «mu»m, 6. K/min; Tstart: 80. C; Tend: 240. C
CapillaryOV-1754.De Pooter, Omar, et al., 198530. m/0.5 mm/0.8 «mu»m, He, 2. K/min; Tstart: 40. C; Tend: 220. C
CapillaryOV-1754.De Pooter, Omar, et al., 198530. m/0.5 mm/0.8 «mu»m, He, 2. K/min; Tstart: 40. C; Tend: 220. C
CapillaryOV-101747.Wang and Sun, 19852. K/min; Column length: 50. m; Column diameter: 0.27 mm; Tstart: 110. C
CapillaryOV-101746.Wang and Sun, 19852. K/min; Column length: 50. m; Column diameter: 0.27 mm; Tstart: 125. C
CapillaryOV-101750.Wang and Sun, 19853. K/min; Column length: 50. m; Column diameter: 0.27 mm; Tstart: 80. C
CapillaryOV-101750.Wang and Sun, 19854. K/min; Column length: 50. m; Column diameter: 0.27 mm; Tstart: 80. C
CapillaryOV-101748.Wang and Sun, 19852. K/min; Column length: 50. m; Column diameter: 0.27 mm; Tstart: 95. C
CapillarySE-30749.Korhonen, 19846. K/min; Column length: 25. m; Column diameter: 0.3 mm; Tstart: 50. C
CapillarySE-30749.Korhonen, 19846. K/min; Column length: 25. m; Column diameter: 0.3 mm; Tstart: 50. C
CapillarySE-52782.de Pooter, Montens, et al., 1983He, 1. K/min; Column length: 150. m; Column diameter: 0.6 mm; Tstart: 10. C; Tend: 200. C

Van Den Dool and Kratz RI, non-polar column, custom temperature program

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Column type Active phase I Reference Comment
CapillaryVF-5MS780.Tret'yakov, 200830. m/0.25 mm/0.25 «mu»m, He; Program: Multi-step temperature program; T(initial)=60C; T(final)=270C
CapillaryDB-5786.Sampaio and Nogueira, 200630. m/0.25 mm/0.25 «mu»m; Program: 40C(2min) => 4C/min => 220C => 20C/min => 280C
CapillaryDB-5763.Mayr, van Ruth, et al., 200360. m/0.32 mm/1. «mu»m, He; Program: 40 C(4min) => 2C/min => 90C => 4C/min => 130C => 8C/min => 250C
CapillaryRTX-5776.Fuhrmann and Grosch, 2002Program: not specified
CapillaryDB-5768.Beaulieu and Grimm, 200130. m/0.25 mm/0.25 «mu»m, He; Program: 50C (1min) => 5C/min => 100C => 10C/min => 250C (9min)
CapillaryBPX-5771.Bauchot, Mottram, et al., 199850. m/0.32 mm/0.50 «mu»m, He; Program: 0 0C (8 min) -> (1 min) -> 50 0C (2 min) 2.5 0C/min -> 100 0C 6 0C/min -> 250 0C

Van Den Dool and Kratz RI, polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryDB-Wax1029.Gurbuz O., Rouseff J.M., et al., 200660. m/0.25 mm/0.25 «mu»m, He, 7. K/min, 265. C @ 5. min; Tstart: 40. C
CapillaryDB-Wax1005.Gurbuz O., Rouseff J.M., et al., 200630. m/0.32 mm/0.5 «mu»m, He, 7. K/min, 265. C @ 5. min; Tstart: 40. C
CapillaryCP-Wax 52CB1017.Kourkoutas, Elmore, et al., 200660. m/0.25 mm/0.25 «mu»m, He, 4. K/min; Tstart: 40. C; Tend: 250. C
CapillaryDB-Wax1000.Osorio, Alarcon, et al., 200630. m/0.25 mm/0.25 «mu»m, He, 50. C @ 4. min, 4. K/min, 220. C @ 20. min
CapillaryDB-Wax1031.Petka, Ferreira, et al., 200630. m/0.32 mm/0.5 «mu»m, 40. C @ 3. min, 5. K/min, 200. C @ 8. min
CapillaryStabilwax1029.Fang and Qian, 200530. m/0.32 mm/1. «mu»m, N2, 40. C @ 2. min, 4. K/min, 230. C @ 10. min
CapillaryDB-Wax1022.Aubert and Bourger, 200430. m/0.25 mm/0.25 «mu»m, H2, 40. C @ 3. min, 3. K/min, 250. C @ 20. min
CapillaryDB-Wax1002.Varming, Andersen, et al., 200430. m/0.25 mm/0.25 «mu»m, He, 40. C @ 10. min, 6. K/min, 240. C @ 25. min
CapillaryDB-Wax1007.Varming, Petersen, et al., 200430. m/0.25 mm/0.25 «mu»m, He, 40. C @ 10. min, 6. K/min, 240. C @ 25. min
CapillaryCarbowax1027.Censullo, Jones, et al., 200360. m/0.25 mm/0.5 «mu»m, He, 50. C @ 10. min, 5. K/min, 250. C @ 10. min
CapillaryAT-Wax989.Pino and Marbot, 200160. m/0.32 mm/0.25 «mu»m, He, 65. C @ 10. min, 2. K/min, 250. C @ 60. min
CapillaryAT-Wax986.Pino, Marbot, et al., 200160. m/0.32 mm/0.25 «mu»m, He, 65. C @ 10. min, 2. K/min, 250. C @ 60. min
CapillaryDB-FFAP1014.Charles, Martin, et al., 200030. m/0.32 mm/0.25 «mu»m, H2, 40. C @ 2. min, 5. K/min; Tend: 240. C
CapillaryHP-Wax993.Christensen, Jakobsen, et al., 199750. m/0.2 mm/0.4 «mu»m, He, 30. C @ 1. min, 5. K/min, 220. C @ 30. min
CapillaryCP-Wax 52CB1012.Chyau, Mau, et al., 199650. m/0.23 mm/0.12 «mu»m, H2, 50. C @ 10. min, 1.5 K/min, 200. C @ 10. min
CapillaryDB-Wax1013.Sumitani, Suekane, et al., 1994He, 40. C @ 5. min, 3. K/min; Column length: 60. m; Column diameter: 0.25 mm; Tend: 200. C
CapillaryDB-Wax1019.Stashenko, Macku, et al., 1992He, 35. C @ 5. min, 3. K/min; Column length: 60. m; Column diameter: 0.25 mm; Tend: 180. C
CapillaryDB-Wax1011.Umano, Hagi, et al., 1992He, 40. C @ 10. min, 2. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tend: 200. C
CapillaryOV-3511009.Korhonen, 19846. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 50. C
CapillaryOV-3511009.Korhonen, 19846. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 50. C
CapillaryCarbowax 20M1012.Chen, Kuo, et al., 1982He, 50. C @ 10. min, 1. K/min; Tend: 160. C
PackedCarbowax 20M1002.van den Dool and Kratz, 1963Celite 545, 4.6 K/min; Tstart: 75. C; Tend: 228. C

Van Den Dool and Kratz RI, polar column, custom temperature program

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Column type Active phase I Reference Comment
CapillarySupelcowax-101018.Bianchi, Careri, et al., 200730. m/0.25 mm/0.25 «mu»m, He; Program: 35C(8min) => 4C/min => 60C => 6C/min => 160C => 20C/min => 200C(1min)
CapillarySupelcowax-101016.Bianchi, Careri, et al., 200730. m/0.25 mm/0.25 «mu»m, He; Program: 40C(1min) => 10C/min => 120C => 15C/min => 200C (1min)
CapillaryDB-Wax1034.Escudero, Campo, et al., 200730. m/0.32 mm/0.5 «mu»m, H2; Program: 40C(5min) => 4C/min => 100C6C/min => 136C => 3C/min => 220C (10min)
CapillaryDB-Wax1010.Mehinagic, Royer, et al., 200630. m/0.25 mm/0.5 «mu»m, He; Program: 40C => 5C/min => 60C(30min) => 5C/min => 240C
CapillaryDB-Wax1012.Mehinagic, Royer, et al., 200630. m/0.25 mm/0.5 «mu»m, He; Program: 40C => 5C/min => 60C(30min) => 5C/min => 240C
CapillarySOLGel-Wax1009.Aubert, Baumann, et al., 200530. m/0.25 mm/0.25 «mu»m, He; Program: 35C(5min) => 3C/min => 150C => 5C/min => 250C (10min)
CapillarySOLGel-Wax1009.Aubert, Baumann, et al., 200530. m/0.25 mm/0.25 «mu»m, He; Program: 35C(5min) => 3C/min => 150C => 5C/min => 250C(10 min)
CapillaryDB-Wax1035.Campo, Ferreira, et al., 200530. m/0.32 mm/0.5 «mu»m, H2; Program: 40C(5min) => 4C/min => 100C => 6C/min => 200C
CapillaryDB-Wax985.Ferrari, Lablanquie, et al., 200460. m/0.25 mm/0.25 «mu»m, He; Program: 35C(0.7min) => 20C/min => 70C => 4C/min => 240C
CapillaryCarbowax 20M1015.Boido, Lloret, et al., 200325. m/0.32 mm/0.25 «mu»m, H2; Program: 40C (8min) => 3C/min => 180C => 20C/min => 230C
CapillaryFFAP1004.Yasuhara, 198750. m/0.25 mm/0.25 «mu»m, He; Program: 20C (5min) => 2C/min => 70C => 4C/min => 210C

Normal alkane RI, non-polar column, isothermal

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Column type Active phase Temperature (C) I Reference Comment
CapillaryDB-160.757.Shimadzu, 2003, 260. m/0.32 mm/1. «mu»m, He
PackedSE-3070.766.Yabumoto, Jennings, et al., 1977 
PackedDC-400150.734.Anderson, 1968Helium, Gas-Pak (60-80 mesh); Column length: 3.0 m

Normal alkane RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryHP-5 MS749.Raffo, Kelderer, et al., 200930. m/0.25 mm/0.25 «mu»m, Helium, 40. C @ 2. min, 4. K/min, 250. C @ 5. min
CapillaryDB-5770.Xu, Fan, et al., 200730. m/0.32 mm/0.25 «mu»m, He, 40. C @ 2. min, 4. K/min, 250. C @ 5. min
CapillaryDB-5770.Fan and Qian, 200630. m/0.32 mm/1. «mu»m, He, 40. C @ 2. min, 4. K/min, 250. C @ 15. min
CapillaryDB-5767.El-Sayed, Heppelthwaite, et al., 200530. m/0.25 mm/0.25 «mu»m, 40. C @ 2. min, 4. K/min; Tend: 240. C
CapillaryHP-5779.5Leffingwell and Alford, 200560. m/0.32 mm/0.25 «mu»m, He, 30. C @ 2. min, 2. K/min, 260. C @ 28. min
CapillaryBP-1757.Health Safety Executive, 200050. m/0.22 mm/0.75 «mu»m, He, 5. K/min; Tstart: 50. C; Tend: 200. C
CapillaryMethyl Silicone764.Vendramini and Trugo, 200050. m/0.25 mm/0.5 «mu»m, H2, 40. C @ 0.5 min, 4. K/min; Tend: 260. C
CapillaryHP-1760.Ong and Acree, 19984. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 35. C; Tend: 250. C
CapillaryHP-1760.Ong, Acree, et al., 19984. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 35. C; Tend: 250. C
CapillaryHP-5770.Larsen and Frisvad, 199535. C @ 2. min, 6. K/min; Tend: 200. C
CapillaryDB-5758.Shimoda, Shibamoto, et al., 199360. m/0.25 mm/0.25 «mu»m, He, 40. C @ 2. min, 3. K/min; Tend: 200. C
CapillaryDB-1744.Shiota, 199330. m/0.25 mm/0.25 «mu»m, He, 50. C @ 5. min, 3. K/min; Tend: 240. C
CapillaryDB-1745.Shiota, 199330. m/0.25 mm/0.25 «mu»m, He, 50. C @ 5. min, 3. K/min; Tend: 240. C
CapillaryDB-1743.Shiota, 199330. m/0.25 mm/0.25 «mu»m, He, 50. C @ 3. min, 5. K/min; Tend: 240. C
CapillaryDB-1744.Shiota, 199330. m/0.25 mm/0.25 «mu»m, He, 50. C @ 3. min, 5. K/min; Tend: 240. C
CapillaryDB-1754.Peppard, 199230. m/0.25 mm/1.0 «mu»m, He, 3. K/min, 250. C @ 30. min; Tstart: 40. C
CapillaryDB-1758.Peppard, 199230. m/0.25 mm/1.0 «mu»m, He, 3. K/min, 250. C @ 30. min; Tstart: 40. C
CapillaryDB-1764.Takeoka and Butter, 1989He, 30. C @ 4. min, 2. K/min; Column length: 60. m; Column diameter: 0.32 mm; Tend: 210. C
CapillaryDB-1764.Takeoka and Butter, 1989He, 30. C @ 4. min, 2. K/min; Column length: 60. m; Column diameter: 0.32 mm; Tend: 210. C
CapillarySE-30758.Dirinck, de Pooter, et al., 1981N2, 2. K/min; Column length: 200. m; Column diameter: 0.6 mm; Tstart: 20. C; Tend: 220. C

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

View large format table.

Column type Active phase I Reference Comment
CapillaryCP-Sil 5 CB730.Collin, Nizet, et al., 201250. m/0.32 mm/1.20 «mu»m, Nitrogen; Program: 36 0C 20 0C/min -> 85 0C 1 0C/min -> 145 0C 3 0C/min -> 250 0C (30 min)
CapillaryPolydimethyl siloxane with 5 % Ph groups780.Robinson, Adams, et al., 2012Program: not specified
CapillaryPolydimethyl siloxane with 5 % Ph groups782.Robinson, Adams, et al., 2012Program: not specified
CapillaryDB-5771.San-Juan, Petka, et al., 201030. m/0.32 mm/0.50 «mu»m, Hydrogen; Program: 40 0C (5 min) 4 0C/min -> 100 0C 6 0C/min -> 220 0C (20 min)
CapillaryHP-5772.Zhao, Li, et al., 200830. m/0.25 mm/0.25 «mu»m; Program: 40 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)
CapillaryHP-5781.Zhao, Li, et al., 200830. m/0.25 mm/0.25 «mu»m; Program: not specified
CapillaryDB-5768.Beaulieu and Lancaster, 200730. m/0.25 mm/0.25 «mu»m; Program: 50C(1min) => 5C/min => 100C => 10C/min => 250C (9min)
CapillaryMethyl Silicone750.Chen and Feng, 2007Program: not specified
CapillaryVB-5772.Karlshøj, Nielsen, et al., 200760. m/0.25 mm/1. «mu»m, He; Program: 35C(1min) => 4C/min => 175C => 10C/min => 260C
CapillarySE-30750.Liu, Liang, et al., 2007Program: not specified
CapillaryDB-5768.Beaulieu, 200560. m/0.25 mm/0.25 «mu»m; Program: 50C => 5C/min => 100C => 15C/min => 250C (19C)
CapillarySE-30758.Vinogradov, 2004Program: not specified
CapillaryHP-5753.Jordán, Margaría, et al., 200330. m/0.25 mm/0.25 «mu»m; Program: 40C(6min) => 2.5C/min => 150C => 90C/min => 250C
CapillaryHP-5767.Jordán, Margaría, et al., 200330. m/0.25 mm/0.25 «mu»m; Program: 40C(6min) => 2.5C/min => 150C => 90C/min => 250C
CapillaryBPX-5772.Machiels, van Ruth, et al., 200360. m/0.32 mm/1. «mu»m, He; Program: 40C (4min) => 2C/min => 90C => 4C/min => 130C => 8C/min => 250 C (10min)
CapillaryHP-5753.Jordán, Goodner, et al., 200230. m/0.25 mm/0.25 «mu»m; Program: not specified
CapillaryHP-5758.Jordán, Goodner, et al., 200230. m/0.25 mm/0.25 «mu»m; Program: not specified
CapillaryMFE-73775.Aznar, López, et al., 200130. m/0.32 mm/0.1 «mu»m, H2; Program: 40C(5min) => 2C/min => 120C => 10C/min => 210C(30min)
CapillaryHP-5749.Jordán, Shaw, et al., 200130. m/0.25 mm/0.25 «mu»m; Program: 40C (6min) => 2.5C/min => 150C => 90C/min => 250C
CapillaryMethyl Silicone758.Estrada and Gutierrez, 1999Program: not specified
CapillarySPB-1759.Flanagan, Streete, et al., 199760. m/0.53 mm/5. «mu»m, He; Program: 40C(6min) => 5C/min => 80C => 10C/min => 200C
CapillaryDB-1762.Ciccioli, Cecinato, et al., 199460. m/0.32 mm/0.25 «mu»m; Program: not specified
CapillaryDB-1762.Ciccioli, Brancaleoni, et al., 199360. m/0.32 mm/0.25 «mu»m; Program: 3 min at 5 C; 5 - 50 C at 3 deg/min; 50 - 220 C at 5 deg/min
CapillarySPB-1759.Strete, Ruprah, et al., 199260. m/0.53 mm/5.0 «mu»m, Helium; Program: 40 0C (6 min) 5 0C/min -> 80 0C 10 0C/min -> 200 0C
CapillarySPB-1754.Strete, Ruprah, et al., 199260. m/0.53 mm/5.0 «mu»m, Helium; Program: not specified
CapillaryDB-1750.Takeoka, Flath, et al., 198830. m/0.25 mm/0.25 «mu»m, H2; Program: 30C (2min) => 2C/min => 150C => 4C/min => 250C
CapillaryDB-1755.Takeoka, Flath, et al., 198830. m/0.25 mm/0.25 «mu»m, H2; Program: 30C (2min) => 2C/min => 150C => 4C/min => 250C
CapillaryOV-101748.Zenkevich and Malamakhov, 1987He; Column length: 50. m; Column diameter: 0.24 mm; Program: not specified
CapillaryOV-101758.Zenkevich and Malamakhov, 1987He; Column length: 50. m; Column diameter: 0.24 mm; Program: not specified
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.749.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.746.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.748.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.750.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryOV-1753.Ramsey and Flanagan, 1982Program: not specified

Normal alkane RI, polar column, isothermal

View large format table.

Column type Active phase Temperature (C) I Reference Comment
CapillaryDB-Wax60.1032.Shimadzu, 2003, 250. m/0.32 mm/1. «mu»m, He
PackedCarbowax 20M100.1008.Yabumoto, Jennings, et al., 1977 

Normal alkane RI, polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryCP-Wax CB1000.Alves, da Penha, et al., 201230. m/0.25 mm/0.25 «mu»m, Helium, 2. K/min, 150. C @ 5. min; Tstart: 50. C
CapillaryVF-Wax MS1009.Duarte, Dias, et al., 201060. m/0.25 mm/0.25 «mu»m, Helium, 60. C @ 5. min, 3. K/min, 220. C @ 25. min
CapillaryDB-Wax1000.Zhao, Xu, et al., 200930. m/0.25 mm/0.25 «mu»m, Helium, 40. C @ 2. min, 3. K/min, 230. C @ 5. min
CapillaryCP-Wax 57 CB998.Callejon, Morales, et al., 200850. m/0.25 mm/0.20 «mu»m, Hydrogen, 35. C @ 5. min, 4. K/min, 150. C @ 17.5 min
CapillaryDB-Wax988.Xu, Fan, et al., 200730. m/0.25 mm/0.25 «mu»m, He, 40. C @ 2. min, 4. K/min, 230. C @ 5. min
CapillaryDB-Wax988.Fan and Qian, 200630. m/0.32 mm/0.25 «mu»m, He, 40. C @ 2. min, 4. K/min, 230. C @ 15. min
CapillaryHP-Innowax992.Komes, Ulrich, et al., 200630. m/0.25 mm/0.5 «mu»m, He, 40. C @ 3. min, 2. K/min, 200. C @ 15. min
CapillaryDB-Wax1005.Fan and Qian, 200530. m/0.32 mm/0.25 «mu»m, N2, 40. C @ 2. min, 4. K/min, 230. C @ 5. min
CapillaryDB-Wax1000.Rizzolo, Cambiaghi, et al., 200560. m/0.53 mm/1. «mu»m, 50. C @ 10. min, 3. K/min; Tend: 180. C
CapillaryDB-Wax1005.Culleré, Escudero, et al., 200430. m/0.32 mm/0.5 «mu»m, H2, 40. C @ 5. min, 4. K/min; Tend: 200. C
CapillaryDB-Wax1014.Hayata, Sakamoto, et al., 200260. m/0.25 mm/0.25 «mu»m, He, 40. C @ 10. min, 3. K/min, 220. C @ 10. min
CapillaryDB-Wax1007.Umano, Hagi, et al., 200260. m/0.25 mm/0.25 «mu»m, He, 40. C @ 2. min, 2. K/min; Tend: 200. C
CapillaryDB-Wax1005.Aznar, López, et al., 200130. m/0.32 mm/0.5 «mu»m, H2, 40. C @ 5. min, 4. K/min, 200. C @ 60. min
CapillaryDB-Wax1005.Wei, Mura, et al., 200160. m/0.25 mm/0.25 «mu»m, He, 2. K/min; Tstart: 40. C; Tend: 200. C
CapillaryHP-Innowax1009.Ong and Acree, 19984. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 35. C; Tend: 250. C
CapillaryHP-Innowax1009.Ong, Acree, et al., 19984. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 35. C; Tend: 250. C
CapillaryDB-Wax1017.Young, Gilbert, et al., 199630. m/0.32 mm/0.50 «mu»m, Hydrogen, 30. C @ 6. min, 3. K/min; Tend: 190. C
CapillaryDB-Wax1010.Takeoka and Butter, 198960. m/0.32 mm/0.25 «mu»m, He, 30. C @ 4. min, 2. K/min; Tend: 180. C
CapillaryDB-Wax1011.Takeoka and Butter, 198960. m/0.32 mm/0.25 «mu»m, He, 30. C @ 4. min, 2. K/min; Tend: 180. C
CapillaryDB-Wax1014.Takeoka, Flath, et al., 198860. m/0.25 mm/0.25 «mu»m, H2, 30. C @ 2. min, 2. K/min; Tend: 180. C
CapillaryDB-Wax1014.Takeoka, Flath, et al., 198860. m/0.25 mm/0.25 «mu»m, H2, 30. C @ 2. min, 2. K/min; Tend: 180. C

Normal alkane RI, polar column, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillaryPEG-20M Innowax1047.Wang, Tian, et al., 201330. m/0.25 mm/0.25 «mu»m, Nitrogen; Program: 50 0C (7 min) 20 0C/min -> 130 0C (1 min) 1 0C/min -> 150 0C 8 0C/min -> 190 0C (5 min)
CapillaryCarbowax 20M1019.Lee, Chong, et al., 2012Program: not specified
CapillaryHP-Innowax1020.Xiao, Dai, et al., 201160. m/0.25 mm/0.25 «mu»m, Helium; Program: 40 0C (2 min) 3 0C/min -> 150 0C 5 0C/min -> 220 0C (5 min)
CapillaryDB-Wax1012.San-Juan, Petka, et al., 201030. m/0.32 mm/0.50 «mu»m, Hydrogen; Program: 40 0C (5 min) 4 0C/min -> 100 0C 6 0C/min -> 220 0C (20 min)
CapillaryDB-Wax1012.Ferreira, Juan, et al., 200930. m/0.32 mm/0.50 «mu»m; Program: 40 0C (5 min) 4 0C/min -> 100 0C 6 0C/min -> 220 0C (40 min)
CapillaryFFAP976.Ortiz, Echeverra, et al., 200950. m/0.20 mm/0.33 «mu»m, Helium; Program: 70 0C (1 min) 3 0C/min -> 142 0C 5 0C/min -> 225 0C (10 min)
CapillaryDB-Wax1024.Valappil, Fan, et al., 200930. m/0.32 mm/0.50 «mu»m, Helium; Program: 40 0C 7 0C/min -> 110 0C 15 0C/min -> 250 0C (3 min)
CapillaryDB-Wax985.Zhao, Xu, et al., 200930. m/0.25 mm/0.25 «mu»m, Helium; Program: not specified
CapillarySupelcowax 101017.Soria, Martinez-Castro, et al., 200850. m/0.25 mm/0.25 «mu»m, Helium; Program: 45 0C (15 min) 3 0C/min -> 75 0C 5 0C/min -> 180 0C (10 min)
CapillaryFFAP1020.Lara, Echeverría, et al., 200750. m/0.2 mm/0.33 «mu»m, He; Program: 70C(1min) => 3C/min => 142C => 5C/min => 225C (10min)
CapillaryFFAP1020.Lopez, Villatoro, et al., 200750. m/0.2 mm/0.33 «mu»m, He; Program: 70C(1min) => 3C/min => 142C => 5C/min => 225C(10min)
CapillaryDB-Wax987.Tian, Zhang, et al., 200730. m/0.25 mm/0.25 «mu»m, He; Program: 50 0C (2 min) 6 0C/min -> 150 0C 8 0C/min -> 230 0C (15 min)
CapillaryDB-Wax1020.Mattheis, Fan, et al., 200560. m/0.25 mm/0.25 «mu»m, He; Program: 35C(5min) => 2C/min => 50C => 5C/min => 200C (5min)
CapillaryFFAP1020.Echeverría, Correa, et al., 200450. m/0.2 mm/0.33 «mu»m, He; Program: 70C(1min) => 3C/min => 142C => 5C/min => 225C(10min)
CapillaryCarbowax 20M1000.Vinogradov, 2004Program: not specified
CapillaryHP-FFAP1020.Echeverria, Fuentes, et al., 200350. m/0.2 mm/0.33 «mu»m, He; Program: 70C(1min) => 3C/min => 142C => 5C/min => 225C (10min)
CapillaryFFAP1023.Lopez, Lavilla, et al., 200050. m/0.2 mm/0.33 «mu»m, N2; Program: 70C(1min) => 3C/min => 142C(2min) => 25C/min => 230C(5min)
CapillaryCross-linked FFAP1023.Lavilla, Puy, et al., 199950. m/0.2 mm/0.33 «mu»m, N2; Program: 70C(1min) => 3C/min => 142C (2min) => 25C/min => 230C(5min)
CapillaryFFAP1023.López, Lavilla, et al., 199850. m/0.2 mm/0.33 «mu»m, N2; Program: 70C (1min) => 3C/min => 142C (2min) => 25C/min => 230C (5min)
CapillaryCarbowax 20M984.Ramsey and Flanagan, 1982Program: not specified

References

Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Mass spectrum (electron ionization), Gas Chromatography, NIST Free Links, Notes

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

Schjanberg, 1935
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Notes

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