1-Ethyladamantane
- Formula: C12H20
- Molecular weight: 164.2872
- IUPAC Standard InChIKey: LXTHCCWEYOKFSR-UHFFFAOYSA-N
- CAS Registry Number: 770-69-4
- Chemical structure:
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Phase change data
Go To: Top, 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: William E. Acree, Jr., James S. Chickos
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔvapH° | 55.3 ± 1.1 | kJ/mol | N/A | Melkhanova, Pimenova, et al., 2000 |
Enthalpy of vaporization
ΔvapH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
49.1 | 398. | A | Stephenson and Malanowski, 1987 | Based on data from 383. to 492. K. |
Enthalpy of fusion
ΔfusH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
11.28 | 225.6 | AC | Varushchenko, Druzhinina, et al., 2005 | Based on data from 8. to 373. K. |
Mass spectrum (electron ionization)
Go To: Top, Phase change data, 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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
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Due to licensing restrictions, this spectrum cannot be downloaded.
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-IW-4051 |
NIST MS number | 237222 |
Gas Chromatography
Go To: Top, Phase change data, 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
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Capillary | SE-30 | 190. | 1301. | Sarkisova and Pimerzin, 2005 | He; Column length: 50. m; Column diameter: 0.2 mm |
Capillary | Squalane | 110. | 1241.9 | Bender, Said, et al., 1986 | He; Column length: 100. m; Column diameter: 0.25 mm |
Capillary | SE-30 | 145. | 1260. | Bogoslovsky, Anvaer, et al., 1978 | |
Capillary | Squalane | 100. | 1234. | Bogoslovsky, Anvaer, et al., 1978 | |
Capillary | Squalane | 110. | 1240. | Bogoslovsky, Anvaer, et al., 1978 | |
Capillary | Squalane | 125. | 1249. | Bogoslovsky, Anvaer, et al., 1978 | |
Capillary | Squalane | 140. | 1259. | Bogoslovsky, Anvaer, et al., 1978 | |
Capillary | Squalane | 100. | 1234. | Mitra, Mohan, et al., 1974 | H2; Column length: 50. m; Column diameter: 0.2 mm |
Capillary | Apiezon L | 140. | 1309. | Hála, Eyem, et al., 1970 | N2; Column length: 50. m; Column diameter: 0.2 mm |
Capillary | Squalane | 110. | 1240. | Hála, Eyem, et al., 1970 | N2; Column length: 50. m; Column diameter: 0.2 mm |
Capillary | Squalane | 125. | 1249. | Hála, Eyem, et al., 1970 | N2; Column length: 50. m; Column diameter: 0.2 mm |
Capillary | Squalane | 140. | 1259. | Hála, Eyem, et al., 1970 | N2; Column length: 50. m; Column diameter: 0.2 mm |
Capillary | SE-30 | 145. | 1260. | Burkhard, Vais, et al., 1969 | N2; Column length: 50. m; Column diameter: 0.27 mm |
Capillary | SE-30 | 160. | 1274. | Burkhard, Vais, et al., 1969 | N2; Column length: 50. m; Column diameter: 0.27 mm |
Capillary | SE-30 | 175. | 1286. | Burkhard, Vais, et al., 1969 | N2; Column length: 50. m; Column diameter: 0.27 mm |
Capillary | SE-30 | 190. | 1301. | Burkhard, Vais, et al., 1969 | N2; Column length: 50. m; Column diameter: 0.27 mm |
Kovats' RI, non-polar column, temperature ramp
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | HP-5MS | 1235. | Yang, Wang, et al., 2006 | 30. m/0.25 mm/0.25 μm, 50. C @ 2. min, 6. K/min; Tend: 300. C |
Kovats' RI, polar column, isothermal
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Capillary | Carbowax 20M | 145. | 1448. | Burkhard, Vais, et al., 1969 | N2; Column length: 50. m; Column diameter: 0.27 mm |
Capillary | Carbowax 20M | 160. | 1469. | Burkhard, Vais, et al., 1969 | N2; Column length: 50. m; Column diameter: 0.27 mm |
Capillary | Carbowax 20M | 175. | 1491. | Burkhard, Vais, et al., 1969 | N2; Column length: 50. m; Column diameter: 0.27 mm |
Normal alkane RI, non-polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | Polydimethyl siloxane | 1260. | Bayat and Abad, 2011 | Program: not specified |
Capillary | Polydimethyl siloxane | 1260. | Bayat and Abad M.F.Y., 2011 | Program: not specified |
References
Go To: Top, Phase change data, 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.
Melkhanova, Pimenova, et al., 2000
Melkhanova, S.V.; Pimenova, S.M.; Kolesov, V.P.; Pimerzin, A.A.; Sarkisova, V.S.,
The standard molar enthalpies of formation of some alkyladamantanes,
The Journal of Chemical Thermodynamics, 2000, 32, 10, 1311-1317, https://doi.org/10.1006/jcht.2000.0691
. [all data]
Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw,
Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2
. [all data]
Varushchenko, Druzhinina, et al., 2005
Varushchenko, R.M.; Druzhinina, A.I.; Senyavin, V.M.; Sarkisova, V.S.,
The low-temperature heat capacities, phase transitions and thermodynamic properties of 1,3-dimethyladamantane and 1-ethyladamantane,
The Journal of Chemical Thermodynamics, 2005, 37, 2, 141-151, https://doi.org/10.1016/j.jct.2004.06.009
. [all data]
Sarkisova and Pimerzin, 2005
Sarkisova, V.S.; Pimerzin, A.A.,
Gas chromatographic characteristics and boiling points of diadamantanes,
Pet. Chem. USSR (Engl. Transl.), 2005, 45, 1, 63-66. [all data]
Bender, Said, et al., 1986
Bender, A.O.; Said, E.Z.; Abdulsada, A.K.,
Gas chromatographic identification of adamantanes in some Iraqi crude oils,
Analyst, 1986, 111, 5, 575-576, https://doi.org/10.1039/an9861100575
. [all data]
Bogoslovsky, Anvaer, et al., 1978
Bogoslovsky, Yu.N.; Anvaer, B.I.; Vigdergauz, M.S.,
Chromatographic constants in gas chromatography (in Russian), Standards Publ. House, Moscow, 1978, 192. [all data]
Mitra, Mohan, et al., 1974
Mitra, G.D.; Mohan, G.; Sinha, A.,
Gas chromatographic analysis of complex hydrocarbon mixtures,
J. Chromatogr. A, 1974, 91, 633-648, https://doi.org/10.1016/S0021-9673(01)97944-0
. [all data]
Hála, Eyem, et al., 1970
Hála, S.; Eyem, J.; Burkhard, J.; Landa, S.,
Retention indices of adamantanes,
J. Chromatogr. Sci., 1970, 8, 4, 203-209, https://doi.org/10.1093/chromsci/8.4.203
. [all data]
Burkhard, Vais, et al., 1969
Burkhard, J.; Vais, J.; Vodicka, L.; Landa, S.,
Adamantane and its derivatives. XVI. The gas chromatographic characterization of adamantane derivatives,
J. Chromatogr., 1969, 42, 207-218, https://doi.org/10.1016/S0021-9673(01)80617-8
. [all data]
Yang, Wang, et al., 2006
Yang, C.; Wang, Z.D.; Hollebone, B.P.; Peng, X.; Fingas, M.; Landriault, M.,
GC/MS Quantitation of diamondoid compounds in crude oils and petroleum products,
Environmental Forensics, 2006, 7, 4, 377-390, https://doi.org/10.1080/15275920600996396
. [all data]
Bayat and Abad, 2011
Bayat, Z.; Abad, M.F.Y.,
Quantitative structure-property relationship (QSPR) study of Kovats retention indices of some of adamantane derivatives by the genetic algorithm amd nultiply linear regression (GA-MLR) method,
Petroleum Coal, 2011, 53, 2, 132-140. [all data]
Bayat and Abad M.F.Y., 2011
Bayat, Z.; Abad M.F.Y.,
Computational approaches to the prediction of the Kovats retention index (RI) for adamantane derivatives (AD) as a drug,
J. Chem. Pharm. Res., 2011, 3, 1, 48-55. [all data]
Notes
Go To: Top, Phase change data, Mass spectrum (electron ionization), Gas Chromatography, References
- Symbols used in this document:
ΔfusH Enthalpy of fusion ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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