Diallyl phthalate

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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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Δfliquid-131.4kcal/molCcbMedard and Thomas, 1955 
Δfliquid-132.0 ± 1.7kcal/molCcbTavernier and Lamouroux, 1955Reanalyzed by Cox and Pilcher, 1970, Original value = -128.66 kcal/mol
Quantity Value Units Method Reference Comment
Δcliquid-1663.5kcal/molCcbMedard and Thomas, 1955Corresponding Δfliquid = -131.4 kcal/mol (simple calculation by NIST; no Washburn corrections)
Δcliquid-1662.9 ± 1.7kcal/molCcbTavernier and Lamouroux, 1955Reanalyzed by Cox and Pilcher, 1970, Original value = -1666.27 kcal/mol; Corresponding Δfliquid = -132.02 kcal/mol (simple calculation by NIST; no Washburn corrections)

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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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 Japan AIST/NIMC Database- Spectrum MS-NW- 275
NIST MS number 228069

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Gas Chromatography

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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

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

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Column type Active phase I Reference Comment
PackedSE-301698.Ramsey, Lee, et al., 1980He, Chromosorb G HP (80-100 mesh); Column length: 1.5 m; Program: not specified

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

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Column type Active phase I Reference Comment
PackedSE-301708.Helaimia and Messadi, 1989Chromosorb Q, 10. K/min; Column length: 2. m; Tstart: 100. C
PackedSE-301718.Helaimia and Messadi, 1989Chromosorb Q, 10. K/min; Column length: 2. m; Tstart: 100. C
PackedSE-301708.Messadi and Vergnaud, 1979N2, Chromosorb Q, 10. K/min; Tstart: 100. C; Tend: 340. C

Normal alkane RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
PackedSE-301711.Lourici, Souici, et al., 1999Nitrogen, Chromosorb Q (60-80 mesh), 8. K/min; Column length: 2. m; Tstart: 100. C; Tend: 290. C
PackedSE-301712.Lourici, Souici, et al., 1999Nitrogen, Chromosorb Q (60-80 mesh), 8. K/min; Column length: 2. m; Tstart: 100. C; Tend: 290. C
PackedSE-301713.Lourici, Souici, et al., 1999Nitrogen, Chromosorb Q (60-80 mesh), 8. K/min; Column length: 2. m; Tstart: 100. C; Tend: 290. C
PackedSE-301713.Lourici, Souici, et al., 1999Nitrogen, Chromosorb Q (60-80 mesh), 8. K/min; Column length: 2. m; Tstart: 100. C; Tend: 290. C
PackedSE-301714.Lourici, Souici, et al., 1999Nitrogen, Chromosorb Q (60-80 mesh), 8. K/min; Column length: 2. m; Tstart: 100. C; Tend: 290. C
PackedSE-301714.Lourici, Souici, et al., 1999Nitrogen, Chromosorb Q (60-80 mesh), 8. K/min; Column length: 2. m; Tstart: 100. C; Tend: 290. C
PackedSE-301714.Lourici, Souici, et al., 1999Nitrogen, Chromosorb Q (60-80 mesh), 8. K/min; Column length: 2. m; Tstart: 100. C; Tend: 290. C
CapillaryUltra-11692.Okumura, 199125. m/0.32 mm/0.25 μm, He, 3. K/min; Tstart: 80. C; Tend: 260. C

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

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Column type Active phase I Reference Comment
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.1698.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.1712.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
OtherMethyl Silicone1712.Ardrey and Moffat, 1981Program: not specified

References

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

Medard and Thomas, 1955
Medard, L.; Thomas, M., Chaleurs de combustion de sept substances explosives ou apparentees a des explosifs, Mem. Poudres, 1955, 37, 129-138. [all data]

Tavernier and Lamouroux, 1955
Tavernier, P.; Lamouroux, M., Determinations calorimetriques relatives a douze substances organiques susceptibles d'utilisation dans les poudres, Mem. Poudres, 1955, 37, 197-206. [all data]

Cox and Pilcher, 1970
Cox, J.D.; Pilcher, G., Thermochemistry of Organic and Organometallic Compounds, Academic Press, New York, 1970, 1-636. [all data]

Ramsey, Lee, et al., 1980
Ramsey, J.D.; Lee, T.D.; Osselton, M.D.; Moffat, A.C., Gas-liquid chromatographic retention indices of 296 non-drug substances on SE-30 or OV-1 likely to be encountered in toxicological analyses, J. Chromatogr., 1980, 184, 2, 185-206, https://doi.org/10.1016/S0021-9673(00)85641-1 . [all data]

Helaimia and Messadi, 1989
Helaimia, F.; Messadi, D., Determination of linear programmed temperature gas chromatography retention indices for some plasticizers, C.R. Acad. Sci. Ser. 2:, 1989, 309, 37-42. [all data]

Messadi and Vergnaud, 1979
Messadi, D.; Vergnaud, J.-M., Quick identification and analysis of plasticizers in PVC by programmed-temperature gas chromatography using the best stationary phases, J. Appl. Polym. Sci., 1979, 24, 5, 1215-1225, https://doi.org/10.1002/app.1979.070240507 . [all data]

Lourici, Souici, et al., 1999
Lourici, L.; Souici, M.-L.; Rebbani, N.; Messadi, D., Independent of local properties mathematical models for the calculation of retention indices in programmed temperature gas chromatography, Analusis, 1999, 27, 3, 249-254, https://doi.org/10.1051/analusis:1999114 . [all data]

Okumura, 1991
Okumura, T., retention indices of environmental chemicals on methyl silicone capillary column, Journal of Environmental Chemistry (Japan), 1991, 1, 2, 333-358, https://doi.org/10.5985/jec.1.333 . [all data]

Waggott and Davies, 1984
Waggott, A.; Davies, I.W., Identification of organic pollutants using linear temperature programmed retention indices (LTPRIs) - Part II, 1984, retrieved from http://dwi.defra.gov.uk/research/completed-research/reports/dwi0383.pdf. [all data]

Ardrey and Moffat, 1981
Ardrey, R.E.; Moffat, A.C., Gas-liquid chromatographic retention indices of 1318 substances of toxicological interest on SE-30 or OV-1 stationary phase, J. Chromatogr., 1981, 220, 3, 195-252, https://doi.org/10.1016/S0021-9673(00)81925-1 . [all data]


Notes

Go To: Top, Condensed phase thermochemistry data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References