低场核磁共振技术结合化学计量学快速鉴别花生油真伪

    Rapid adulteration identification of peanut oil based on chemometrics using low-field nuclear magnetic resonance

    • 摘要: 将低场核磁共振技术与化学计量学相结合鉴别花生油真伪,基于油脂低场核磁共振回波衰减曲线的差异,采用主成分分析区分花生油和掺伪植物油,分别利用聚类分析和支持向量机对花生油掺入大豆油(玉米油)进行鉴别,通过网格搜索法和粒子群算法选择合适的核函数并优化支持向量机的核参数,比较了基于支持向量机构建的全局模型与专一模型的通用性和预测效果。结果表明:基于油脂低场核磁回波衰减数据判别油脂种类是可行的;与聚类分析相比,低场核磁回波衰减数据结合支持向量机可更好地鉴别花生油真伪,其全局模型和专一模型的花生油识别率均为100%;全局模型的通用性要优于专一模型,但准确性相差不大。为了扩展模型的应用范围,需要不断补充新样品对模型进行更新。

       

      Abstract: Owing to its pleasant flavor and rich nutrition, peanut oil is popular among consumers.However, as the price of peanut oil increases year by year, peanut oil is prone to adulteration by the unscrupulous dealers.The adulteration of oil not only infringes upon the rights and interests of consumers, food processors and industries, but also leads to potential health risks.Therefore, it is particularly important to establish a simple and rapid method to detect adulteration in peanut oil.In this study, using the low-field nuclear magnetic resonance(LF-NMR)technology and Chemometrics, a new approach was proposed for the adulteration identification of peanut oil.At first, based on the differences in the attenuation curve of the LF-NMR Carr-Purcell-Meiboom-Gill(CPMG)echo of oils, principal component analysis(PCA)algorithm was used to distinguish peanut oil from adulterated vegetable oils(soybean oil and corn oil).Then, the corresponding discriminant models were developed using cluster analysis(CA)and support vector machine(SVM)algorithm respectively.The parameters and kernel functions of SVM-based model were optimized by grid search method and particle swarm algorithm.At last, the versatility and prediction performances of the SVM-based global model and the SVM-based specific models were compared.Experimental results showed that all samples met the national standard requirements, and all kinds of vegetable oil species can be distinguished by LF-NMR CPMG echo attenuation data combined with PCA algorithm.Peanut oil resides on the left side of the principal component score graph, while the other vegetable oils(soybean oil and corn oil)reside on the right side of the 3D score plot of principal components.The optimal identification rate of the CA-based models was 55.3%, and the detection limit of adulteration identification of peanut oil(soybean oil and corn oil)was 60%.Compared with CA-based models, the SVM-based model using LF-NMR CPMG echo attenuation data can achieve better performances in adulteration identification of peanut oil.When radical basis funcition(RBF)was selected as the optimal kernel functions, the identification rate of the global model and the specific model was equal to 100% with the detection limit of 5%.Moreover, for the SVM-based models, the generality of the global model was better than that of the specific model, but the accuracy of these models were not much different.In addition, it is necessary to continue to add new samples to expand the library, so as to further improve the applicability and accuracy of this model.

       

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