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首页> 外文期刊>Talanta: The International Journal of Pure and Applied Analytical Chemistry >Determination of benzene, toluene and xylene concentration in humid air using differential ion mobility spectrometry and partial least squares regression
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Determination of benzene, toluene and xylene concentration in humid air using differential ion mobility spectrometry and partial least squares regression

机译:差分离子迁移率光谱法和偏最小二乘回归法测定湿空气中苯,甲苯和二甲苯的浓度

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Benzene, toluene and xylene (BTX compounds) are chemicals of greatest concern due to their impact on humans and the environment. In many cases, quantitative information about each of these compounds is required. Continuous, fast-response analysis, performed on site would be desired for this purpose. Several methods have been developed to detect and quantify these compounds in this way. Methods vary considerably in sensitivity, accuracy, ease of use and cost-effectiveness. The aim of this work is to show that differential ion mobility spectrometry (DMS) may be applied for determining concentration of BTX compounds in humid air. We demonstrate, this goal is achievable by applying multivariate analysis of the measurement data using partial least squares (PLS) regression. The approach was tested at low concentrations of these compounds in the range of 5-20 ppm and for air humidity in a range 0-12 g/kg. These conditions correspond to the foreseeable application of the developed approach in occupational health and safety measurements. The average concentration assessment error was about 1 ppm for each: benzene, toluene and xylene. We also successfully determined water vapor content in air. The error achieved was 0.2 g/kg. The obtained results are very promising regarding further development of DMS technique as well as its application. (C) 2016 Elsevier B.V. All rights reserved.
机译:苯,甲苯和二甲苯(BTX化合物)是最受关注的化学物质,因为它们会对人类和环境造成影响。在许多情况下,需要有关每种化合物的定量信息。为此,需要在现场进行连续,快速响应的分析。已经开发了几种方法以这种方式检测和定量这些化合物。方法在灵敏度,准确性,易用性和成本效益方面差异很大。这项工作的目的是表明差分离子迁移谱法(DMS)可用于确定潮湿空气中BTX化合物的浓度。我们证明,通过使用偏最小二乘(PLS)回归对测量数据进行多变量分析,可以实现此目标。在5-20 ppm的低浓度这些化合物以及0-12 g / kg的空气湿度下测试了该方法。这些条件与已开发方法在职业健康和安全测量中的可预见应用相对应。苯,甲苯和二甲苯各自的平均浓度评估误差约为1 ppm。我们还成功地确定了空气中的水蒸气含量。达到的误差为0.2 g / kg。对于DMS技术的进一步发展及其应用,所获得的结果很有希望。 (C)2016 Elsevier B.V.保留所有权利。

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