Triphenylene, 1,2,3,4,5,6,7,8,9,10,11,12-dodecahydro-
- Formula: C18H24
- Molecular weight: 240.3832
- IUPAC Standard InChI: InChI=1S/C18H24/c1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18/h1-12H2
- IUPAC Standard InChIKey: ODHYDPYRIQKHCI-UHFFFAOYSA-N
- CAS Registry Number: 1610-39-5
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Other names: Dodecahydrotriphenylene; Tritetralin; 1,2,3,4,5,6,7,8,9,10,11,12-Dodecahydrotriphenylene; Dodecahydrotri-o-phenylene
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Gas phase ion energetics data
Go To: Top, 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 as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
Ionization energy determinations
| IE (eV) | Method | Reference | Comment |
|---|---|---|---|
| 7.70 ± 0.05 | PE | Heilbronner, Kovac, et al., 1981 | LLK |
| 8.60 ± 0.03 | EI | Meier, Heiss, et al., 1968 | RDSH |
Gas Chromatography
Go To: Top, Gas phase ion energetics data, 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
Lee's RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | SE-52 | 386.36 | Lee, Vassilaros, et al., 1979 | 12. m/0.3 mm/0.34 μm, He, 2. K/min; Tstart: 50. C; Tend: 250. C |
References
Go To: Top, Gas phase ion energetics data, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Heilbronner, Kovac, et al., 1981
Heilbronner, E.; Kovac, B.; Nutakul, W.; Taggart, A.D.; Thummel, R.P.,
Trisannelated benzenes. Preparation, properties, and photoelectron spectra,
J. Org. Chem., 1981, 46, 5279. [all data]
Meier, Heiss, et al., 1968
Meier, H.; Heiss, J.; Suhr, H.; Muller, E.,
Energetische Untersuchungen zum Mills-Nixon-Effekt. Ionisierungsenergien von Benzolmolekulen mit ankondensierten gesattigten Ringen,
Tetrahedron, 1968, 24, 2307. [all data]
Lee, Vassilaros, et al., 1979
Lee, M.L.; Vassilaros, D.L.; White, C.M.; Novotny, M.,
Retention Indices for Programmed-Temperature Capillary-Column Gas Chromatography of Polycyclic Aromatic Hydrocarbons,
Anal. Chem., 1979, 51, 6, 768-773, https://doi.org/10.1021/ac50042a043
. [all data]
Notes
Go To: Top, Gas phase ion energetics data, Gas Chromatography, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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