Vacuum-ultraviolet absorption cross-sections of functionalized cyclic hydrocarbons: Five-membered rings

被引:9
|
作者
Christianson, Matthew G. [1 ]
Doner, Anna C. [1 ]
Koritzke, Alanna L. [1 ]
Frandsen, Kelsey [1 ]
Rotavera, Brandon [1 ,2 ]
机构
[1] Univ Georgia, Dept Chem, Athens, GA 30602 USA
[2] Univ Georgia, Coll Engn, 110 Riverbend Rd Off 133, Athens, GA 30602 USA
关键词
LOW-TEMPERATURE COMBUSTION; OXIDATION; SPECTRA; KINETICS; CHEMISTRY; PATHWAYS; FURAN; GAS;
D O I
10.1016/j.jqsrt.2020.107274
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
Cross-sections were measured at 50 degrees C and 800 Torr using differential absorption spectroscopy in the vacuum-ultraviolet from 5.17 - 9.92 eV for a series of five-membered cyclic hydrocarbons: cyclopentane, cyclopentene, methylcyclopentane, tetrahydrofuran, furan, 2-methyltetrahydrofuran, 2,3-dihydro-5-methylfuran, tetrahydrofuran-3-one, 2-methyl-1,3-dioxolane, cyclopentanol, 2-hydroxytetrahydrofuran, cyclopentanone, 2-cyclopenten-1-one, 3-cyclopenten-1-one, 2-methylcyclopentan-1-one, 2-methylcyclopent-2-en-1-one, 1,2-epoxycyclopentane, 2,3-epoxycyclopentanone, and 3,4-epoxycyclopentanone. The majority of the species are functionalized and are directly related to chain-reactions relevant to combustion, such as substituted cyclic ethers and cycloalkenes. Uncertainty calculations were conducted as a function of photon energy to quantify errors associated with experimental repeatability, signal-to-noise ratio, and gas-phase concentration, yielding an upper limit of 5% in spectral regions where absorption is >2%. The primary objective of the present work is to provide quantitative absorption cross-sections of species commonly produced in combustion reactions. Comparing qualitative differences among the five-membered cyclic species, in order to analyze the effect of functional groups on absorption, is a secondary objective. The majority of the spectra are reported for the first time and enable quantitative isomer-resolved speciation measurements in combustion chemistry. (C) 2020 Elsevier Ltd. All rights reserved.
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页数:8
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