Acetic acid, phenylmethyl ester

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Condensed phase thermochemistry data

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

Data compiled by: Eugene S. Domalski and Elizabeth D. Hearing

Constant pressure heat capacity of liquid

Cp,liquid (cal/mol*K) Temperature (K) Reference
35.49298.15Fuchs, 1979
36.81306.0Phillip, 1939
59.80292.7Kolosovskii and Udovenko, 1934
59.80292.7de Kolossowsky and Udowenko, 1933

Phase change data

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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:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos

Quantity Value Units Method Reference Comment
Tboil479.2KN/AAldrich Chemical Company Inc., 1990BS
Tboil487.KN/AAmerican Tokyo Kasei, 1988BS
Tboil487.15KN/AKatti and Chaudhri, 1964Uncertainty assigned by TRC = 0.5 K; TRC
Tboil488.1KN/ALecat, 1927Uncertainty assigned by TRC = 0.5 K; TRC
Tboil488.1KN/ALecat, 1926Uncertainty assigned by TRC = 0.5 K; TRC
Quantity Value Units Method Reference Comment
Tfus221.65KN/ATimmermans, 1921Uncertainty assigned by TRC = 0.3 K; TRC
Quantity Value Units Method Reference Comment
Δvap13.3kcal/molAStephenson and Malanowski, 1987Based on data from 283. - 490. K.; AC

Reduced pressure boiling point

Tboil (K) Pressure (atm) Reference Comment
407.0.134Buckingham and Donaghy, 1982BS

Enthalpy of vaporization

ΔvapH (kcal/mol) Temperature (K) Method Reference Comment
14.4305.MESerpinskii, Voitkevich, et al., 1954Based on data from 283. - 328. K.; AC

Antoine Equation Parameters

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

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Temperature (K) A B C Reference Comment
319. - 429.2.33730791.918-175.864Gardner and Brewer, 1937Coefficents 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, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), 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: Michael M. Meot-Ner (Mautner) and Sharon G. Lias

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

C3H3+ + Acetic acid, phenylmethyl ester = (C3H3+ • Acetic acid, phenylmethyl ester)

By formula: C3H3+ + C9H10O2 = (C3H3+ • C9H10O2)

Quantity Value Units Method Reference Comment
Δr10.kcal/molHPMSField, 1969gas phase; Entropy change is questionable
Quantity Value Units Method Reference Comment
Δr-7.cal/mol*KHPMSField, 1969gas phase; Entropy change is questionable

Gas phase ion energetics data

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

Data compiled by: John E. Bartmess

Electron affinity determinations

EA (eV) Method Reference Comment
0.15 ± 0.10ECDZlatkis, Lee, et al., 1983 

Ion clustering data

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

Data compiled by: Michael M. Meot-Ner (Mautner) and Sharon G. Lias

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. Searches may be limited to ion clustering reactions. A general reaction search form is also available.

Clustering reactions

C3H3+ + Acetic acid, phenylmethyl ester = (C3H3+ • Acetic acid, phenylmethyl ester)

By formula: C3H3+ + C9H10O2 = (C3H3+ • C9H10O2)

Quantity Value Units Method Reference Comment
Δr10.kcal/molHPMSField, 1969gas phase; Entropy change is questionable
Quantity Value Units Method Reference Comment
Δr-7.cal/mol*KHPMSField, 1969gas phase; Entropy change is questionable

IR Spectrum

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Data compiled by: Coblentz Society, Inc.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director


Mass spectrum (electron ionization)

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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 NIST Mass Spectrometry Data Center
NIST MS number 341647

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, Gas phase ion energetics data, Ion clustering data, IR Spectrum, 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, isothermal

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Column type Active phase Temperature (C) I Reference Comment
CapillarySE-30120.1135.Tudor and Moldovan, 1999 
CapillarySE-30100.1135.1Tudor, 199740. m/0.35 mm/0.35 μm
CapillarySE-30200.1154.Tarjan, Nyiredy, et al., 1989 
PackedSE-30150.1145.Tiess, 1984Ar, Gas Chrom Q (80-100 mesh); Column length: 3. m
PackedSE-30200.1154.Haken, Hartley, et al., 1983Chromosorb W AW DMCS; Column length: 3.7 m
PackedOV-1140.1163.Tomori, Kalasz, et al., 1974N2, Gas Chrom Q; Column length: 2. m
PackedOV-1150.1168.Tomori, Kalasz, et al., 1974N2, Gas Chrom Q; Column length: 2. m
PackedOV-1160.1177.Tomori, Kalasz, et al., 1974N2, Gas Chrom Q; Column length: 2. m

Kovats' RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryDB-51170.El-Massry, El-Ghorab, et al., 200230. m/0.25 mm/0.5 μm, 50. C @ 3. min, 7. K/min, 250. C @ 10. min
CapillaryOV-1011136.Gaydou, Randriamiharisoa, et al., 1986100. m/0.3 mm/0.15 μm, H2, 2. K/min; Tstart: 90. C; Tend: 220. C
CapillaryOV-1011138.Yamaguchi and Shibamoto, 1981N2, 2. K/min; Column length: 70. m; Column diameter: 0.28 mm; Tstart: 80. C; Tend: 200. C
CapillaryOV-1011138.Yamaguchi and Shibamoto, 1981N2, 2. K/min; Column length: 70. m; Column diameter: 0.28 mm; Tstart: 80. C; Tend: 200. C

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

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Column type Active phase I Reference Comment
CapillaryBP-11141.Khan, Verma, et al., 200630. m/0.32 mm/0.25 μm, N2; Program: 60C => 5C/min => 220C (5min) => 3C/min => 245C(5min)
CapillarySPB-11131.Riu-Aumatell, Castellari, et al., 200430. m/0.25 mm/0.25 μm; Program: not specified

Kovats' RI, polar column, isothermal

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Column type Active phase Temperature (C) I Reference Comment
CapillaryCarbowax 20M150.1762.Tudor, Moldovan, et al., 1999Phase thickness: 0.45 μm

Kovats' RI, polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryBP-201708.Khan, Verma, et al., 200630. m/0.32 mm/0.25 μm, N2, 5. K/min, 220. C @ 14. min; Tstart: 60. C
CapillaryPE-Wax1713.Venkateshwarlu, Chandravadana, et al., 1999N2, 60. C @ 4. min, 5. K/min, 200. C @ 5. min; Column length: 30. m; Column diameter: 0.25 mm
CapillarySupelcowax-101747.Wong and Teng, 1994He, 35. C @ 5. min, 3. K/min, 200. C @ 20. min; Column length: 60. m; Column diameter: 0.25 mm
CapillaryBP-201771.Wyllie and Leach, 199070. C @ 2. min, 4. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tend: 200. C
CapillaryCarbowax 20M1695.Nishimura, Yamaguchi, et al., 19892. K/min; Column length: 50. m; Column diameter: 0.22 mm; Tstart: 80. C; Tend: 200. C
CapillaryCarbowax 20M1693.Gaydou, Randriamiharisoa, et al., 198650. m/0.3 mm/0.15 μm, H2, 2. K/min; Tstart: 70. C; Tend: 210. C
CapillaryCarbowax 20M1688.Toda, Mihara, et al., 19832. K/min; Column length: 50. m; Column diameter: 0.23 mm; Tstart: 80. C; Tend: 200. C
CapillaryCarbowax 20M1689.Toda, Mihara, et al., 19832. K/min; Column length: 50. m; Column diameter: 0.23 mm; Tstart: 80. C; Tend: 200. C
CapillaryCarbowax 20M1710.Buttery, Seifert, et al., 1982He, 1. K/min; Column length: 150. m; Column diameter: 0.64 mm; Tstart: 50. C; Tend: 170. C
CapillaryCarbowax 20M1689.Yamaguchi and Shibamoto, 1981N2, 2. K/min; Column length: 70. m; Column diameter: 0.28 mm; Tstart: 80. C; Tend: 200. C
CapillaryCarbowax 20M1690.Yamaguchi and Shibamoto, 1981N2, 2. K/min; Column length: 70. m; Column diameter: 0.28 mm; Tstart: 80. C; Tend: 200. C

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

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Column type Active phase I Reference Comment
CapillarySPB-51165.Balbontin, Gaete-Eastman, et al., 200730. m/0.25 mm/0.25 μm, He, 50. C @ 2. min, 20. K/min, 220. C @ 2. min
CapillaryHP-1011141.Politeo, Jukic, et al., 200725. m/0.20 mm/0.20 μm, Helium, 70. C @ 2. min, 3. K/min, 200. C @ 15. min
CapillaryDB-51164.Fang and Qian, 200530. m/0.32 mm/1. μm, N2, 40. C @ 2. min, 4. K/min, 230. C @ 10. min
CapillaryHP-5MS1165.Pino, Mesa, et al., 200530. m/0.25 mm/0.25 μm, He, 60. C @ 2. min, 4. K/min, 250. C @ 20. min
CapillarySPB-51163.Pino, Marbot, et al., 200430. m/0.25 mm/0.25 μm, He, 60. C @ 2. min, 4. K/min, 250. C @ 20. min
CapillaryBP-11149.Raina, Kumar, et al., 200430. m/0.32 mm/0.25 μm, N2, 5. K/min, 220. C @ 13. min; Tstart: 60. C
CapillaryDB-51165.Reis, Pansarim, et al., 200430. m/0.25 mm/0.25 μm, He, 4. K/min; Tstart: 50. C; Tend: 290. C
CapillaryDB-11159.Boyom, Assembe, et al., 200330. m/0.25 mm/0.25 μm, N2, 5. K/min, 200. C @ 0. min; Tstart: 50. C
CapillaryHP-51162.Skaltsa, Demetzos, et al., 200330. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 4. K/min; Tend: 280. C
CapillaryDB-11128.2Sun and Stremple, 200330. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 40. C; Tend: 325. C
CapillaryDB-51168.3Xu, van Stee, et al., 200330. m/0.25 mm/1. μm, He, 2.5 K/min; Tstart: 50. C; Tend: 200. C
CapillaryDB-51165.Flamini, Cioni, et al., 200230. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 60. C; Tend: 240. C
CapillaryHP-51164.Flamini, Cioni, et al., 2002, 230. m/0.25 mm/0.25 μm, N2, 60. C @ 10. min, 5. K/min; Tend: 220. C
CapillaryHP-51162.Couladis, Tsortanidou, et al., 200130. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 60. C; Tend: 380. C
CapillaryHP-51164.Shalit, Katzir, et al., 2001He, 50. C @ 1. min, 4. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tend: 200. C
CapillaryHP-51169.David, Scanlan, et al., 200050. m/0.32 mm/1.05 μm, He, 2. K/min; Tstart: 50. C; Tend: 290. C
CapillarySE-301143.Paramonov, Khalilova, et al., 20006. K/min; Column length: 50. m; Column diameter: 0.2 mm; Tstart: 50. C; Tend: 250. C
CapillaryDB-51161.Isidorov, Zenkevich, et al., 199830. m/0.25 mm/0.25 μm, 3. K/min; Tstart: 50. C; Tend: 250. C
CapillaryDB-11147.Bartelt, 199730. m/0.32 mm/5. μm, He, 35. C @ 1. min, 10. K/min; Tend: 270. C
CapillaryDB-11139.Stashenko, Prada, et al., 199660. m/0.25 mm/0.25 μm, He, 50. C @ 5. min, 3.5 K/min; Tend: 250. C
CapillaryDB-51151.Vahirua-Lechat, Menut, et al., 1996He, 2. K/min, 200. C @ 30. min; Column length: 30. m; Column diameter: 0.32 mm; Tstart: 80. C
CapillaryDB-11147.Adedeji, Hartman, et al., 199160. m/0.25 mm/0.25 μm, He, 40. C @ 3. min, 2. K/min, 280. C @ 10. min
CapillaryDB-11129.4Chang, Sheng, et al., 19892. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 300. C
CapillaryDB-11131.8Chang, Sheng, et al., 19892. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 300. C
CapillaryCP Sil 5 CB1137.Halket and Schulten, 198526. m/0.32 mm/1.25 μm, 10. K/min; Tstart: 100. C; Tend: 250. C
CapillaryCP Sil 5 CB1139.Halket and Schulten, 198526. m/0.32 mm/1.25 μm, 10. K/min; Tstart: 100. C; Tend: 250. C
PackedSE-301141.van den Dool and Kratz, 1963Celite; Tstart: 75. C; Tend: 228. C

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

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Column type Active phase I Reference Comment
CapillaryDB-51162.Andrade, Sampaio, et al., 200730. m/0.25 mm/0.25 μm, He; Program: 40C(2min) => 4C/min => 220C => 20C/min => 280C
CapillaryVF-5MS1160.Carasek and Pawliszyn, 200630. m/0.25 mm/0.25 μm, He; Program: 40C(2min) => 5C/min => 200C (2min) => 30C/min => 260C
CapillaryDB-51162.Sampaio and Nogueira, 200630. m/0.25 mm/0.25 μm; Program: 40C(2min) => 4C/min => 220C => 20C/min => 280C
CapillaryDB-5MS1172.Selli, Rannou, et al., 200630. m/0.32 mm/0.5 μm, He; Program: 50C => 5C/min => 200C => 8C/min => 260C(5min)
Capillary5 % Phenyl methyl siloxane1162.Sacchetti, Maietti, et al., 200530. m/0.32 mm/0.15 μm, He; Program: 45C => 1C/min => 100C => 5C/min => 250C (10min)
CapillaryDB-51164.Beaulieu and Grimm, 200130. m/0.25 mm/0.25 μm, He; Program: 50C (1min) => 5C/min => 100C => 10C/min => 250C (9min)
CapillaryHP-51163.Isidorov, Krajewska, et al., 200130. m/0.25 mm/0.25 μm, He; Program: 50C => 6C/min => 100C => 4C/min => 280C
CapillaryBPX-51184.Bauchot, Mottram, et al., 199850. m/0.32 mm/0.50 μm, He; Program: 0 0C (8 min) -> (1 min) -> 50 0C (2 min) 2.5 0C/min -> 100 0C 6 0C/min -> 250 0C
CapillaryDB-11137.Mikolajczak, Zilkowski, et al., 1984He; Column length: 15. m; Column diameter: 0.32 mm; Program: not specified
PackedOV-11160.Tomori, Kalasz, et al., 1974N2, Gas Chrom Q; Column length: 2. m; Program: not specified

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

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Column type Active phase I Reference Comment
CapillaryHP-20M1682.Politeo, Jukic, et al., 200750. m/0.20 mm/0.20 μm, Helium, 70. C @ 4. min, 4. K/min, 180. C @ 15. min
CapillaryDB-Wax Etr1733.Aubert C. and Pitrat M., 200630. m/0.25 mm/0.25 μm, He, 40. C @ 3. min, 5. K/min, 250. C @ 15. min
CapillaryCP-Wax 52CB1741.Kourkoutas, Elmore, et al., 200660. m/0.25 mm/0.25 μm, He, 4. K/min; Tstart: 40. C; Tend: 250. C
CapillaryOV-3511696.Bonvehí, 200550. m/0.32 mm/0.2 μm, He, 5. K/min; Tstart: 60. C; Tend: 220. C
CapillaryStabilwax1739.Fang and Qian, 200530. m/0.32 mm/1. μm, N2, 40. C @ 2. min, 4. K/min, 230. C @ 10. min
CapillaryDB-Wax1754.Aubert and Bourger, 200430. m/0.25 mm/0.25 μm, H2, 40. C @ 3. min, 3. K/min, 250. C @ 20. min
CapillaryCP-Wax 52CB1733.Ferrari, Lablanquie, et al., 200430. m/0.25 mm/0.2 μm, He, 80. C @ 4. min, 10. K/min; Tend: 240. C
CapillaryZB-Wax1726.Ledauphin, Saint-Clair, et al., 200430. m/0.25 mm/0.15 μm, He, 35. C @ 5. min, 5. K/min, 220. C @ 10. min
CapillaryOV-3511696.Bonvehi and Coll, 200350. m/0.32 mm/0.2 μm, He, 5. K/min; Tstart: 60. C; Tend: 220. C
CapillaryHP-Innowax1742.Christensen, Jakobsen, et al., 1999He, 32. C @ 1. min, 2. K/min, 220. C @ 40. min; Column length: 60. m; Column diameter: 0.25 mm
CapillaryHP-Wax1767.Christensen, Jakobsen, et al., 199750. m/0.2 mm/0.4 μm, He, 30. C @ 1. min, 5. K/min, 220. C @ 30. min
CapillaryDB-Wax1742.Stashenko, Prada, et al., 199660. m/0.25 mm/0.25 μm, He, 50. C @ 5. min, 2.5 K/min; Tend: 180. C
CapillaryDB-Wax1714.Iwaoka, Hagi, et al., 1994He, 40. C @ 5. min, 2. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tend: 200. C
CapillaryDB-Wax1738.Sumitani, Suekane, et al., 1994He, 40. C @ 5. min, 3. K/min; Column length: 60. m; Column diameter: 0.25 mm; Tend: 200. C
CapillaryCarbowax 20M1690.Suárez and Duque, 19912. K/min; Column length: 25. m; Column diameter: 0.31 mm; Tstart: 50. C; Tend: 200. C
CapillaryCarbowax 20M1697.Suárez and Duque, 19912. K/min; Column length: 25. m; Column diameter: 0.31 mm; Tstart: 50. C; Tend: 200. C
CapillaryDB-Wax1720.4Chang, Sheng, et al., 19892. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 240. C
CapillaryDB-Wax1722.3Chang, Sheng, et al., 19892. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 240. C
CapillaryDB-Wax1710.Fröhlich, Duque, et al., 198930. m/0.25 mm/0.25 μm, He, 50. C @ 3. min, 4. K/min; Tend: 250. C
CapillaryDB-Wax1711.Fröhlich, Duque, et al., 198930. m/0.25 mm/0.25 μm, He, 50. C @ 3. min, 4. K/min; Tend: 250. C
CapillaryCarbowax 20M1710.Chen, Kuo, et al., 1986He, 50. C @ 5. min, 2. K/min, 200. C @ 40. min; Column length: 50. m; Column diameter: 0.32 mm
CapillaryCarbowax 20M1706.Chen, Kuo, et al., 1982He, 50. C @ 10. min, 1. K/min; Tend: 160. C
PackedCarbowax 20M1728.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
CapillaryCP-Wax 52CB1731.Romeo, Ziino, et al., 200760. m/0.25 mm/0.25 μm, He; Program: 45C(5min) => 10C/min => 80C => 2C/min => 240C
CapillaryFFAP1748.Frauendorfer and Schieberle, 200625. m/0.32 mm/0.2 μm, He; Program: 40C(1min) => 40C/min => 60C(1min) => 6C/min => 180C => 15C/min => 240C
CapillarySOLGel-Wax1691.Aubert, Baumann, et al., 200530. m/0.25 mm/0.25 μm, He; Program: 35C(5min) => 3C/min => 150C => 5C/min => 250C(10 min)
CapillarySOLGel-Wax1691.Aubert, Baumann, et al., 200530. m/0.25 mm/0.25 μm, He; Program: 35C(5min) => 3C/min => 150C => 5C/min => 250C (10min)
CapillaryDB-Wax1740.Klesk and Qian, 200330. m/0.25 mm/0.5 μm, He; Program: 40C(2min) => 2C/min => 100C => 10C/min => 230C (5min)

Normal alkane RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryHP-5 MS1164.Nawrath, Mgode, et al., 201230. m/0.25 mm/0.25 μm, Helium, 50. C @ 5. min, 5. K/min; Tend: 320. C
CapillaryVF-5 MS1165.Leffingwell and Alford, 201160. m/0.32 mm/0.25 μm, Helium, 2. K/min, 260. C @ 28. min; Tstart: 30. C
CapillaryVF-5 MS1167.Leffingwell and Alford, 201160. m/0.32 mm/0.25 μm, Helium, 2. K/min, 260. C @ 28. min; Tstart: 30. C
CapillaryHP-5 MS1162.Pino, Marquez, et al., 201030. m/0.32 mm/0.25 μm, Helium, 50. C @ 2. min, 4. K/min, 240. C @ 10. min
CapillaryHP-5 MS1167.Radulovic, Blagojevic, et al., 201030. m/0.25 mm/0.25 μm, Helium, 5. K/min, 290. C @ 10. min; Tstart: 70. C
CapillaryZB-51169.Alagarmalai, Nestel, et al., 200930. m/0.25 mm/0.25 μm, Helium, 60. C @ 2. min, 10. K/min, 230. C @ 10. min
CapillaryHP-5 MS1163.Raffo, Kelderer, et al., 200930. m/0.25 mm/0.25 μm, Helium, 40. C @ 2. min, 4. K/min, 250. C @ 5. min
CapillaryRTX-5 MS1174.Edris, Chizzola, et al., 200730. m/0.25 mm/0.25 μm, He, 60. C @ 2. min, 2. K/min, 200. C @ 10. min
CapillaryHP-51165.Farsam, Amanlou, et al., 200730. m/0.25 mm/0.26 μm, Helium, 60. C @ 2. min, 4. K/min, 240. C @ 20. min
CapillaryZB-51155.Mohottalage, Tabacchi, et al., 200730. m/0.25 mm/0.25 μm, 60. C @ 5. min, 4. K/min, 220. C @ 20. min
CapillaryHP-51162.Bertrand, Comte, et al., 200660. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 60. C; Tend: 250. C
CapillaryHP-11129.Castel, Fernandez, et al., 200650. m/0.2 mm/0.5 μm, He, 2. K/min, 250. C @ 120. min; Tstart: 60. C
CapillaryUltra-21170.Schlumpberger B.O., Clery R.A., et al., 200650. m/0.25 mm/0.32 μm, He, 2. K/min; Tstart: 50. C; Tend: 270. C
CapillaryFSOT-RSL-2001160.Schmidt, Jirovetz, et al., 200630. m/0.32 mm/0.25 μm, Hydrogen, 40. C @ 5. min, 6. K/min, 280. C @ 5. min
CapillaryBPX-51178.Dickschat, Martens, et al., 200525. m/0.22 mm/0.25 μm, He, 50. C @ 5. min, 5. K/min; Tend: 320. C
CapillaryZB-51174.Dötterl and Jürgens, 200560. m/0.25 mm/0.25 μm, He, 40. C @ 7. min, 6. K/min, 250. C @ 1. min
CapillaryZB-51174.Dötterl, Wolfe, et al., 200560. m/0.25 mm/0.25 μm, He, 40. C @ 7. min, 6. K/min, 250. C @ 1. min
CapillaryHP-51163.0Leffingwell and Alford, 200560. m/0.32 mm/0.25 μm, He, 30. C @ 2. min, 2. K/min, 260. C @ 28. min
CapillaryHP-5MS1161.Setzer, Noletto, et al., 200530. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 3. K/min; Tend: 280. C
CapillaryHP-5MS1163.Tesevic, Nikicevic, et al., 200530. m/0.25 mm/0.25 μm, He, 4.3 K/min; Tstart: 60. C; Tend: 285. C
CapillarySPB-11136.Wong and Tan, 200550. m/0.2 mm/0.33 μm, He, 50. C @ 3. min, 4. K/min, 220. C @ 30. min
CapillaryZB-51180.Jürgens and Dötterl, 200460. m/0.25 mm/0.25 μm, He, 40. C @ 4.6 min, 6. K/min, 260. C @ 1. min
CapillaryDB-51160.Woerdenbag, Windono, et al., 200430. m/0.249 mm/0.25 μm, He, 3. K/min; Tstart: 60. C; Tend: 300. C
CapillaryOV-1011130.Agnaniet, Mounzeo, et al., 200325. m/0.25 mm/0.25 μm, N2, 5. K/min; Tstart: 50. C; Tend: 200. C
CapillaryDB-11127.Fekam Boyom, Ngouana, et al., 200330. m/0.25 mm/0.25 μm, N2, 5. K/min; Tstart: 50. C; Tend: 200. C
CapillaryOV-1011145.Bloss, Acree, et al., 200235. C @ 5. min, 6. K/min; Column length: 10. m; Column diameter: 0.25 mm; Tend: 225. C
CapillarySPB-51177.Kim, Kim, et al., 200060. m/0.25 mm/0.25 μm, He, 70. C @ 8. min, 5. K/min, 240. C @ 20. min
CapillaryHP-11134.Ong, Acree, et al., 19984. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 35. C; Tend: 250. C
CapillaryDB-11133.Stashenko, Torres, et al., 199560. m/0.25 mm/0.25 μm, He, 50. C @ 5. min, 3.5 K/min; Tend: 250. C
CapillaryUltra-11133.Okumura, 199125. m/0.32 mm/0.25 μm, He, 3. K/min; Tstart: 80. C; Tend: 260. C
CapillaryCP Sil 8 CB1169.Jantan and Goh, 199060. C @ 10. min, 3. K/min; Column length: 25. m; Column diameter: 0.20 mm; Tend: 230. C
CapillaryOV-1011167.Wu, Zhao, et al., 1987He, 3. K/min; Column length: 45. m; Column diameter: 0.25 mm; Tstart: 100. C; Tend: 180. C
CapillaryDB-11128.Flath, Mon, et al., 198350. C @ 0.1 min, 4. K/min, 250. C @ 5. min; Column length: 60. m; Column diameter: 0.32 mm

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

View large format table.

Column type Active phase I Reference Comment
CapillaryPolydimethyl siloxane with 5 % Ph groups1165.Robinson, Adams, et al., 2012Program: not specified
CapillaryPolydimethyl siloxane with 5 % Ph groups1171.Robinson, Adams, et al., 2012Program: not specified
CapillarySiloxane, 5 % Ph1165.VOC BinBase, 2012Program: not specified
CapillaryPolydimethyl siloxane, 5 % phenyl1165.Skogerson, Wohlgemuth, et al., 2011Program: not specified
CapillaryZB-1 MS1160.Al-Reza, Rahman, et al., 201030. m/0.25 mm/0.25 μm, Helium; Program: 50 0C 3 0C/min -> 150 0C (10 min) 10 0C/min -> 250 0C
CapillaryCP-Sil 8 CB1166.Di Giusto, Bessiere, et al., 201030. m/0.25 mm/0.25 μm, Helium; Program: Multi-rise program
CapillaryHP-5 MS1162.Pino, Marquez, et al., 201030. m/0.32 mm/0.25 μm, Helium; Program: not specified
CapillaryRTX-51169.Leela, Vipin, et al., 200930. m/0.25 mm/0.25 μm, Nitrogen; Program: 60 0C 95 min) 110 0C 3 0C/min -> 200 0C 5 0C/min -> 220 0C 95 min)
CapillaryRTX-51162.Leela, Vipin, et al., 200930. m/0.25 mm/0.25 μm, Nitrogen; Program: not specified
CapillaryDB-11123.Mendes, Trindade, et al., 200930. m/0.25 mm/0.25 μm, Hydrogen; Program: 45 0C 3 0C/min -> 175 0C 15 0C/min -> 300 0C (10 min)
CapillaryCB-11144.Kannaste, Vongvanich, et al., 200830. m/0.25 mm/0.25 μm, Helium; Program: 40 0C (2 min) 4 0C/min -> 180 0C 20 0C/min -> 220 0C (1 min)
CapillaryCB-11134.Kannaste, Vongvanich, et al., 200830. m/0.25 mm/0.25 μm, Helium; Program: not specified
CapillaryCP Sil 8 CB1163.Kristiawan, Sobolik, et al., 200830. m/0.25 mm/0.25 μm; Program: 60C => 2.5C/min => 170C => 10C/min => 250C (5min)
CapillaryDB-51164.Beaulieu and Lancaster, 200730. m/0.25 mm/0.25 μm; Program: 50C(1min) => 5C/min => 100C => 10C/min => 250C (9min)
CapillaryCP-Sil1163.Proffit, 200730. 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
CapillaryDB-51164.Beaulieu, 200560. m/0.25 mm/0.25 μm; Program: 50C => 5C/min => 100C => 15C/min => 250C (19C)
CapillaryPolydimethyl siloxane with 5 % Ph groups1163.Pino, Marbot, et al., 2005Program: not specified
CapillarySPB-51163.Crook, Boylston, et al., 200430. m/0.25 mm/0.25 μm, He; Program: 30C(3min) => 5C/min => 80C => 4C/min => 95C => 5C/min => 115C => 10C/min => 200C
CapillarySE-301144.Vinogradov, 2004Program: not specified
CapillaryHP-51162.Jordán, Margaría, et al., 200330. m/0.25 mm/0.25 μm; Program: 40C(6min) => 2.5C/min => 150C => 90C/min => 250C
CapillaryHP-51169.1David, Scanlan, et al., 200250. m/0.32 mm/1.05 μm, He; Program: not specified
CapillaryHP-51163.Jordán, Goodner, et al., 200230. m/0.25 mm/0.25 μm; Program: not specified
CapillaryHP-51161.Jordán, Goodner, et al., 200230. m/0.25 mm/0.25 μm; Program: not specified
CapillaryHP-11133.Teai, Claude-Lafontaine, et al., 200150. m/0.32 mm/0.52 μm, N2; Program: 40C => 2C/min => 130C => 4C/min => 250C
CapillaryDB-11123.Baratta, Dorman, et al., 199830. m/0.25 mm/0.25 μm, He; Program: 45C => 3C/min => 175C => 15C/min => 240C (10min)
CapillaryHP-11134.Ong, Acree, et al., 1998Column length: 25. m; Column diameter: 0.32 mm; Program: not specified
CapillaryPolydimethyl siloxanes1136.Zenkevich and Chupalov, 1996Program: not specified
CapillaryOV-1011144.Shibamoto, 1987Program: not specified
CapillaryOV-1011144.Wu, Zhao, et al., 1987He; Column length: 45. m; Column diameter: 0.25 mm; Program: not specified
CapillaryOV-1011146.Zenkevich and Malamakhov, 1987He; Column length: 50. m; Column diameter: 0.24 mm; Program: not specified

Normal alkane RI, polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryHP-Innowax1743.Soria, Sanz, et al., 200850. m/0.20 mm/0.20 μm, Helium, 45. C @ 2. min, 4. K/min, 190. C @ 50. min
CapillaryDB-Wax1765.Wei A. and Shibamoto T., 200760. m/0.25 mm/0.25 μm, He, 60. C @ 8. min, 3. K/min, 180. C @ 80. min
CapillaryInnowax1739.Joichi, Yomogida, et al., 200560. m/0.25 mm/0.25 μm, He, 5. K/min, 240. C @ 30. min; Tstart: 60. C
CapillarySupelcowax-101725.Wong and Tan, 200530. m/0.25 mm/0.25 μm, He, 50. C @ 3. min, 4. K/min, 220. C @ 30. min
CapillaryPEG-20M1720.Narain, Almeida, et al., 200450. m/0.20 mm/0.20 μm, 40. C @ 5. min, 3. K/min, 180. C @ 30. min
CapillaryHP-Innowax1746.Soria, Gonzalez, et al., 200450. m/0.2 mm/0.2 μm, He, 45. C @ 2. min, 4. K/min, 190. C @ 50. min
CapillaryCarbowax 20M1714.Agnaniet, Mounzeo, et al., 200325. m/0.22 mm/0.25 μm, N2, 5. K/min; Tstart: 50. C; Tend: 200. C
CapillaryDB-Wax1726.Hayata, Sakamoto, et al., 200260. m/0.25 mm/0.25 μm, He, 40. C @ 10. min, 3. K/min, 220. C @ 10. min
CapillaryDB-Wax1743.Ito, Sugimoto, et al., 200260. C @ 4. min, 3. K/min; Column length: 60. m; Column diameter: 0.25 mm; Tend: 180. C
CapillaryDB-Wax1727.Lee and Shibamoto, 200130. m/0.25 mm/0.25 μm, He, 3. K/min, 180. C @ 40. min; Tstart: 50. C
CapillarySupelcowax-101703.Kim, Kim, et al., 200030. m/0.32 mm/0.25 μm, He, 70. C @ 8. min, 5. K/min, 240. C @ 20. min
CapillaryPEG-20M1738.Hirose, Joichi, et al., 1999N2, 3. K/min; Column length: 60. m; Column diameter: 0.25 mm; Tstart: 70. C; Tend: 220. C
CapillaryPEG-20M1738.Awano, Honda, et al., 1997He, 3. K/min; Column length: 60. m; Column diameter: 0.25 mm; Tstart: 70. C; Tend: 210. C
CapillaryDB-Wax1692.Stashenko, Torres, et al., 199560. m/0.25 mm/0.25 μm, He, 50. C @ 5. min, 2.5 K/min; Tend: 180. C
CapillaryCarbowax 20M1686.Kawakami and Kobayashi, 1991He, 60. C @ 4. min, 2. K/min; Column length: 50. m; Column diameter: 0.25 mm; Tend: 180. C
CapillarySupelcowax-101759.Loughrin, Hamilton-Kemp, et al., 1990He, 60. C @ 1. min, 2. K/min; Column length: 60. m; Column diameter: 0.32 mm; Tend: 220. C

Normal alkane RI, polar column, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillaryDB-Wax1689.Parker, Tsormpatsidis, et al., 2010Program: not specified
CapillaryHP-20M1714.Chaieb, Hajlaoui, et al., 2007Program: not specified
CapillaryHP-Innowax1689.Quijano and Pino, 200660. m/0.25 mm/0.25 μm, Nitrogen; Program: 50 0C (4 min) -> 40 0C 4 0C/min -> 220 0C
CapillaryDB-FFAP1704.Buettner and Mestres, 200530. m/0.32 mm/0.25 μm; Program: 35C(2min) => 40C/min => 60C(2min) => 6C/min => 180C => 10C/min=230C(10min)
CapillaryCP-Wax 52CB1695.Jales, Maia, et al., 2005Hydrogen; Program: not specified
CapillaryCarbowax 20M1697.Vinogradov, 2004Program: not specified
CapillaryCarbowax 20M1690.Teai, Claude-Lafontaine, et al., 200150. m/0.2 mm/0.2 μm, N2; Program: 60C => 2C/min => 150C => 4C/min => 220C
CapillaryCarbowax 20M1697.Shibamoto, 1987Program: not specified
CapillaryCarbowax 400, Carbowax 20M, Carbowax 1540, Carbowax 4000, Superox 06, PEG 20M, etc.1728.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified

References

Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, 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.

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Phillip, 1939
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Kolosovskii and Udovenko, 1934
Kolosovskii, N.A.; Udovenko, W.W., Specific heat of liquids. II., Zhur. Obshchei Khim., 1934, 4, 1027-1033. [all data]

de Kolossowsky and Udowenko, 1933
de Kolossowsky, N.A.; Udowenko, W.W., Mesure des chaleurs specifique moleculaires de quelques liquides, Compt. rend., 1933, 197, 519-520. [all data]

Aldrich Chemical Company Inc., 1990
Aldrich Chemical Company Inc., Catalog Handbook of Fine Chemicals, Aldrich Chemical Company, Inc., Milwaukee WI, 1990, 1. [all data]

American Tokyo Kasei, 1988
American Tokyo Kasei, TCI American Organic Chemical 88/89 Catalog, American Tokyo Kasei, Portland, OR, 1988, 1610. [all data]

Katti and Chaudhri, 1964
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Stephenson and Malanowski, 1987
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Notes

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