基于近红外光谱技术的茶油脂肪酸含量的快速检测
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国家自然科学基金项目(31401281);湖南省自然科学基金项目(14JJ3115);湖南省高校科技创新团队支持计划(2014207);湖南省科技计划重点研发项目(2016NK2151)


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    摘要:

    为快速准确地测定茶油中脂肪酸含量,建立了应用近红外光谱技术检测茶油中脂肪酸含量的方法。选取市售的156份茶油样品,利用气相色谱仪测定其脂肪酸组成及含量,同时采用近红外光谱仪采集油样的光谱数据,并分析原始(R)光谱、SG平滑(SG)光谱和二阶导数变换(SD)光谱与茶油中脂肪酸含量的相关性,采用偏最小二乘回归法(PLSR)比较全光谱波段与显著性波段对建模精度的影响,优选出茶油中脂肪酸含量的定量检测模型。结果表明:茶油中棕榈酸、油酸和亚油酸含量较高,分别为4.428%~10.931%、78.036%~84.621%、7.013%~9.863%;采集的茶油近红外光谱曲线特征变化较为明显,光谱特征峰的位置分布于8 600~8 200、7 300~6 900、6 000~ 5 500、4 800~4 500和4 500~4 000 cm–1;茶油中棕榈酸含量与R、SG光谱吸光度呈正相关,油酸和亚油酸含量与R、SG光谱吸光度呈负相关,SD光谱数据与棕榈酸、油酸和亚油酸含量之间的相关系数与R和SG光谱吸光度比较,相关性极大被削弱;基于全波段建立的PLSR模型对棕榈酸、油酸和亚油酸含量的整体预测精度略高于显著性波段所建立的模型,校正集相关系数RC和预测集相关系数RP分别为0.837~0.956和0.818~0.938。从模型的复杂程度分析,采用显著性波段建模的输入变量的数量可压缩至全波段建模的25%以下;SG–PLSR模型对棕榈酸、油酸和亚油酸含量的综合预测性能最优,相应的RP和预测集均方根误差(RMSEP)分别为0.938、0.930、0.925和0.560、0.438、0.287。

    Abstract:

    To determine fatty acid content in camellia oil non-destructively and precisely, the method was proposed to determinfatty acid content in camellia oil by near infrared spectroscopy technology. 156 kinds of commercial camellia oil were used as the samples camellia oil fatty acid composition and content was got by using the gas chromatograph, and the near infrared spectrum information collected by using the spectrometer. The correlation between the original spectrum, SG smooth spectral, two derivative transform spectrum and the fatty acid content in camellia oil was respectively analyzed. The optimizing quantitative model was obtained to determine the fatty acid content in camellia oil through the comparison between the full wavelengths and the significant wavelengths using partial least squares regression methods. . The results indicated that main fatty acids of camellia oil were palmitic acid, oleic acid and linoleic acid, which ranged from 4.428% to 10.931%, from 78.036% to 84.621%, from 7.013% to 9.863%, respectively. The spectrum scanning test for camellia oil samples showed that the characteristic variation of spectrum among camellia oil samples was located in 8 600–8 200, 7 300–6 900, 6 000–5 500, 4 800–4 500 and 4 500–4 000 cm–1, respectively. A positive correlation between the content of palmitic acid in camellia oil and the absorbance of R, SG spectrum was observed, and there was a negative correlation between the content of oleic acid and linoleic acid in camellia oil and the absorbance of R, SG spectrum. However, there was a relatively weak correlation between the content of palmitic acid, oleic acid and linoleic acid in camellia oil and the absorbance of SD spectrum compared with R, SG spectrum. The accuracy of PLSR model for the content of palmitic acid, oleic acid and linoleic acid in camellia oil built by the full wavelengths was slightly higher than by the significant wavelengths, whose related RC from 0.837 to 0.956 and RP from 0.818 to 0.938, respectively. For the complexity of two models, input variables to the models built by the significant wavelengths were decreased to below 25% compared to that by the full wavelengths. The performance of SG–PLSR model by the full wavelengths was best to test the content of palmitic acid, oleic acid and linoleic acid in camellia oil, whose related RP and RMSEP were 0.938, 0.930, 0.925 and 0.560, 0.438, 0.287, respectively.

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文韬,郑立章,龚中良,李立君,谢洁飞,马强.基于近红外光谱技术的茶油脂肪酸含量的快速检测[J].湖南农业大学学报:自然科学版,2016,42(6):.

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  • 在线发布日期: 2016-12-02
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