[激光诱导击穿光谱法和紫外可见光谱法检测大豆油中铬含量]

[Detection of Chromium Content in Soybean Oil by Laser Induced Breakdown Spectroscopy and UVE Method].

作者信息

Sun Tong, Wu Yi-qing, Liu Xiu-hong, Mo Xin-xin, Liu Mu-hua

出版信息

Guang Pu Xue Yu Guang Pu Fen Xi. 2016 Oct;36(10):3341-5.

DOI:
Abstract

In order to monitor chromium (Cr) content in soybean oil, laser induced breakdown spectroscopy (LIBS) was used to detect Cr content in this research. Pine wood chips was used to enrich heavy metal of Cr, and the spectra of pine wood chips were acquired in the wavelength range of 206.28~481.77 nm by a two-channel high-precision spectrometer. Then, uninformative variable elimination (UVE) method was used to select sensitive wavelength variables for heavy metal of Cr, and calibration model of Cr in soybean oil was developed with partial least squares (PLS) regression, the performance of the calibration model was compared to univariate and full PLS calibration models. The results indicate that the performance of UVE-PLS calibration model is better than that of univariate and full PLS calibration models, the correlation coefficient, root mean square error of calibration (RMSEC), root mean square error of cross validation (RMSECV), root mean square error of prediction (RMSEP) are 0.990, 0.045 mg·g-1, 0.050 mg·g-1 and 0.054 mg·g-1, respectively. After UVE variable selection, the number of wavelength variables in UVE-PLS calibration model is about 2% of wavelength variables in full PLS calibration model. This means UVE is an effective variable selection method which can select correlative variables for heavy metal of Cr.

摘要

为监测大豆油中的铬(Cr)含量,本研究采用激光诱导击穿光谱法(LIBS)检测Cr含量。利用松木片富集Cr重金属,通过双通道高精度光谱仪在206.28~481.77 nm波长范围内采集松木片的光谱。然后,采用无信息变量消除(UVE)方法选择Cr重金属的敏感波长变量,利用偏最小二乘法(PLS)回归建立大豆油中Cr的校准模型,并将校准模型的性能与单变量和全PLS校准模型进行比较。结果表明,UVE-PLS校准模型的性能优于单变量和全PLS校准模型, 其相关系数、校准均方根误差(RMSEC)、交叉验证均方根误差(RMSECV)、预测均方根误差(RMSEP)分别为0.990、0.045 mg·g-1、0.050 mg·g-1和0.054 mg·g-1。经过UVE变量选择后,UVE-PLS校准模型中的波长变量数量约为全PLS校准模型中波长变量数量的2%。这表明UVE是一种有效的变量选择方法,能够为Cr重金属选择相关变量。

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