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Factors Influencing the Isothermal Retention Indices of 51 Solutes on 12 Stationary Phases of Different Polarity: Applicability of the Solvation Parameter Model

机译:影响不同极性的12个固定相上51种溶质的等温保留指数的因素:溶剂化参数模型的适用性

摘要

Isothermal retention indices (I) at 333–413 K on 12 stationary phases (SPs) covering a wide polarity range of a variety of volatile solutes belonging to 7 one-heteroatom chemical function series and 10 non-series solutes have been determined. The I values were computed with a method (LQG method) which does not require the determination of holdup times of the chromatographic column. I values of some compounds never before studied are reported. The influence on the retention indices of the column temperature, methylene number, and polarity of both the stationary phase and the solute has been studied. The solvation parameter model (SPM) as a function of I has been used for predicting I values, and for unraveling the influence of the polarity of stationary phase and solute on the retention indices. Seeley et al.’s formulation of the SPM has been used for quantifying the influence of polar and non-polar interactions on the I, and for checking the agreement between calculated and experimental values. According to our results, the I values obtained by the modified SPM can be considered equal to the experimental I values at the 99 % confidence level.
机译:已确定在123–413 K的12个固定相(SPs)上的等温保留指数(I),涵盖了属于7个单杂原子化学功能系列和10个非系列溶质的多种挥发性溶质的宽极性范围。用不需要确定色谱柱的保留时间的方法(LQG方法)计算I值。报告了一些从未研究过的化合物的I值。研究了对色谱柱保留温度,亚甲基数以及固定相和溶质极性的保留指数的影响。作为I的函数的溶剂化参数模型(SPM)已用于预测I值,并用于揭示固定相和溶质的极性对保留指数的影响。 Seeley等人的SPM公式已用于量化极性和非极性相互作用对I的影响,并用于检查计算值和实验值之间的一致性。根据我们的结果,可以认为通过修改后的SPM获得的I值等于99%置信度下的实验I值。

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