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Analysis of Methanol Gasoline by ATR-FT-IR Spectroscopy

Journal 2019 · IF 2.217 · 9(24): 5336 · 发表于 2019 年 12 月 6 日
作者: Qi XIA,Lei-ming YUAN,Xiaojing CHEN,Liuwei MENG,Guangzao HUANG
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摘要

Featured ApplicationThe quality of methanol gasoline is important to internal combustion engines. Infrared spectroscopy technology shows its feasibility to qualitatively and quantitatively measure the quality of gasoline. Combined with the chemometrics, this technology can be used to determinate the adulteration category or fineness, providing the qualified gasoline for the market. Spectra analytical technology is a promising method in applying in the gasoline industry and speeding up the industrial application.AbstractMethanol gasoline blends are a more economical, and environmentally friendly fuels than gasoline alone, and are widely used in the transportation industry. The content of methanol in methanol gasoline plays an important role in ensuring the quality of gasoline. In some solutions, due to the shortage of energy and illegal profits, the problem of gasoline adulteration and its fineness, has received more and more attention, which would seriously affect the operating condition and service life of internal combustion engines. Therefore, it is very important to identify the correct level of gasoline. However, the traditional detection method is complex and time-consuming. To this end, the feasibility of using attenuated total reflectance Fourier transform infrared (ATR-FTIR) methods coupled with chemometrics methods were investigated to quantitatively and qualitatively analyze methanol gasoline. The qualitative analysis result of partial least squares discriminant analysis (PLS-DA) obtained 100% and 98.66% accuracy in the calibration set and the prediction set, respectively. As for quantitative analysis; two regression algorithms of partial least squares regression (PLSR) and the least square support vector machine (LS-SVM), as well as two variables selection methods of the successive projections algorithm (UVE) competitive adaptive reweighted sampling (CARS) and uninformative variable elimination (UVE) were combined to establish the quantitative model. By comparing the performance of the optimal models; the UVE-PLSR model performed best with a residual predictive deviation (RPD) value of 6.420. The qualitative and quantitative analysis results demonstrate the feasibility of using ATR-FTIR spectra to detect the methanol in methanol gasoline. It is believed that the promising IR spectra will be widely used in gasoline energy quality control in the further.Keywords:methanol gasoline;infrared spectroscopy;partial least square discriminant analysis (PLS-DA);multivariate regression;variable selection

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