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A rapid Fourier transform infrared spectroscopic method for the determination of 2-TBARS in palm olein

机译:快速傅里叶变换红外光谱法测定棕榈油精中的2-TBARS

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摘要

A rapid, simple, and environmentally friendly Fourier transform infrared (FTIR) spectroscopic method has been developed to directly determine 2-thiobarbituric acid reactive substances (TBARS) in palm olein. Two multivariate methods, partial least squares (PLS) and principal component regression (PCR), were used to build the calibration models that correlate the chemical 2-TBARS values to the selected spectral regions of FTIR data. The calibration models obtained were cross-validated with 'leave-one-out' method before applying to predict the TBARS values in palm olein. However, the calibration models obtained from the PLS method gave lower standard errors of prediction (SEP) compared to PCR. With the spectrometer calibrated, the predicted 2-TBARS results could be obtained within 5 min per sample, a major improvement over the conventional wet chemical method.
机译:已经开发了一种快速,简单且环保的傅里叶变换红外(FTIR)光谱方法,可直接测定棕榈油精中的2-硫代巴比妥酸反应性物质(TBARS)。两种多元方法,偏最小二乘(PLS)和主成分回归(PCR),用于建立将化学2-TBARS值与FTIR数据的选定光谱区域相关的校准模型。在申请预测棕榈油精中的TBARS值之前,使用“留一法”方法对获得的校准模型进行交叉验证。但是,与PCR相比,从PLS方法获得的校准模型具有较低的预测标准误差(SEP)。通过对光谱仪进行校准,可以在每个样品5分钟内获得预计的2-TBARS结果,这是对常规湿化学方法的重大改进。

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