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51.
Summary Methylbenzenes, pyridines and pyrazines were investigated on fused-silica and glass capillary columns coated with SE-30 and
PEG-40M/KF liquid phases, at two temperatures, 80° and 110°C. The contribution of the methylene groups to the partial molar
free sorption energy was determined for methylpyridines and pyrazines. Equations are proposed for the calculation of the retention
indices of methyl pyridines and pyrazines. These equations are based on the ortho- and α-effects of the methyl groups. The
predicted indices have been experimentally tested for six dimethyl- and trimethylpyridines, and four methylpyrazines. Good
accuracy of the calculation permits to use this method for the identification of methylpyridines and pyrazines in complex
mixtures.
Enlarged text of the paper presented at the Eighth International Symposium on Capillary Chromatography, Riva del Garda, Italy,
May 19–21, 1987. 相似文献
52.
The selectivity of a column system, S, defined by equation 28, includes a variation coefficient (β) of plate number with capacity ratio which has a large influence on the peak capacity, as shown in Fig. 18. Some typical chromatograms are given. In order to predict S for a column system from Kovat's Index, equations 40 and 41 are given to calculate the constant of the carbon number rule for squalane at different temperatures or for different stationary phases. The specific retention value of heptane on squalane at different temperatures can be calculated from equation 42. The nonpolarity index, defined by equation 43, was used to calculate the retention value of heptane on various stationary phases. In liquid chromatography, the order of elution may be reversed by changing the composition of the eluent on the same chemically bonded silica (manufactured in China). The linear relations between the log retention values of different kinds of solutes or of a single solute on the silicas of different surface areas when using the same eluent are given. 相似文献
53.
T. Kowalska 《Chromatographia》1990,29(7-8):389-394
Summary In our previous publication we have introduced a new model of solute retention in RP-HPLC systems with ternary mobile phases of the B+AB1+AB2 type (B: acetonitrile or tetrahydrofuran; AB1: methanol; AB2: water). That model proposed no stoichiometric differentiation between acetonitrile and tetrahydrofuran, alternatively present in the solvent system; moreover, it made some very rough assumptions only as to the intermolecular interactions among the mobile phase constituents.This paper introduces a significant refinement to the already established retention model, which is based on the simple quantitative relationships between acetonitrile and tetrahydrofuran, and the remaining components of the ternary liquid system. The refined model is tested with same experimental data. 相似文献
54.
通过对烷烃,醇类等有机物在五种不同极性固定相上的气相色谱保留值的测定,提出了从有机物气相色谱保留值测定其正辛醇/分配系数的公式,研究了从不同极性固定相上测得的保留值来测定其分配系数的准确性,得出烷烃类在所有柱上测得的保留值与其分配系数间均具有很好的关联,烷烃醇类在极性相异柱上的保留值之比值与其分配系数间也有很好的相关性,从而为烷烃及醇类等有机物分配系数的测定提供了一种简单、可靠,易行的新方法。 相似文献
55.
Alessandro D'Aprano Ines Dorina Donato Vincenzo Turco Liveri 《Journal of solution chemistry》1989,18(8):785-793
Static dielectric constants, refractive indices and viscosities of 1-pentanol +2-methyl-2-butanol mixtures were measured at 5, 25 and 45°C. The results show that the mixing of the two isomers modifies the polarizability and the resistence of viscous flow of the system depending on the composition and temperature. Short range intermolecular interactions producing hetero-alcohol open dimers are considered. 相似文献
56.
Summary Gas chromatographic retention indices for 47 C5 to C8 alkenes on OV-101 dimethylsilicone at 50 and 70 °C were determined within a standard deviation of 0.3i.u. Data obtained on
OV-101 are compared with those measured on squalane. The comparison of the retention index and dl/dT values from both columns
is presented as linear regression equations with correlation coefficients greater than 0.98. 相似文献
57.
羟基化合物及其葡醛酸苷化学结构与RP—HPLC保留行为相关性研究 总被引:1,自引:0,他引:1
采用体外孵育生物合成方法获得羟基化合物葡醛酸苷系列化合物,并对其反相高效液相色谱保留行为及底物与其葡醛酸结合物保留行为相关性进行了研究,建立了相应的结构-色谱保留行为相关性方程及葡醛酸苷类代谢物保留行为的预测方法。将QSRR研究扩展到药物代谢物领域,对药物Ⅱ相葡醛酸化代谢产物的HPLC分析提供了帮助。 相似文献
58.
59.
The article reviews in brief, thede novo group additivity approach and, at length, the different topological approaches to obtain predictive and internally consistent
correlations between various properties and structural features of molecules. The stress has mainly been on the molecular
connectivity method. A new rational scheme for nomenclature of connectivity indices of different orders and types is introduced.
The concept of the perturbation connectivity parameter developed by us recently has been applied to obtain correlations for
molar refraction, boiling point, molar volume, heat of atomisation, heat of combustion, heat of vaporisation, magnetic susceptibility
and critical constants of alkanes, alcohols and alkylbenzenes. A comparative study of various approaches reveals that the
present perturbation topological approach has an edge over other similar methods. 相似文献
60.
Vendeuvre C Bertoncini F Thiébaut D Martin M Hennion MC 《Journal of separation science》2005,28(11):1129-1136
Modeling the retention in comprehensive two-dimensional gas chromatography (GC x GC) was achieved using retention indices obtained in conventional GC. Predicted results were compared with experimental data obtained in the two-dimensional separation of a synthetic hydrocarbon mixture. This proved to be helpful in optimizing the operating conditions of GC x GC separation of a complex petroleum sample and in identifying chemical families. 相似文献