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Non-destructive determination of ethanol levels in fermented alcoholic beverages using Fourier transform mid-infrared spectroscopy

机译:傅立叶变换中红外光谱法无损测定发酵酒精饮料中的乙醇含量

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BackgroundTraditional fermented alcoholic beverages are indigenous to a particular area and are prepared by the local people using an age-old techniques and locally available raw materials. The main objective of this work was the direct determination of ethanol in traditional fermented alcoholic beverages using mid infrared spectroscopy with partial least squares regression, verifying the robustness of the calibration models and to assess the quality of beverages. ResultsThe level of ethanol determination in Ethiopian traditional fermented alcoholic beverages was done using mid infrared spectroscopy with partial least squares regression (MIR-PLS). The calibration and validation sets, and real samples spectra were collected with 32 scans from 850–1200?cm?1. A total of 25 synthetic standards (calibration and validation sets) with ethanol (2–10% w/w) and sugars (glucose, fructose, sucrose and maltose) (0–5% w/w) compositions were used to construct and validate the models. Twenty-five different calibration models were validated by cross-validation approach with 25 left out standards. A large number of pre-treatments were verified, but the best pre-treatment was subtracting minimum?+?2nd derivative. The model was found to have the highest coefficients of determination for calibration and cross-validation (0.999, 0.999) and root mean square error of prediction [0.1% (w/w)]. For practical relevance, the MIR-PLS predicted values were compared against the values determined by gas chromatography. The predicted values of the model were found to be in excellent agreement with gas chromatographic measurements. In addition, recovery test was conducted with spiking 2.4–6.4% (w/w) ethanol. Based on the obtained recovery percentage, 85.4–107% (w/w), the matrix effects of the samples were not considerable. ConclusionThe proposed technique, MIR-PLS at 1200–850?cm?1 spectral region was found appropriate to quantify ethanol in fermented alcoholic beverages. Among the studied beverages ( Tella , Netch Tella , Filter Tella , Korefe , Keribo , Borde and Birz ), the average ethanol contents ranged from 0.77–9.1% (v/v). Tej was found to have the highest ethanol content whereas Keribo had the least ethanol content. The developed method was simple, fast, precise and accurate. Moreover, no sample preparation was required at all. However, it should be noted that the present procedure is probably not usable for regulatory purposes (e.g. controlling labelling).
机译:背景技术传统的酒精饮料是特定地区的土特产,由当地人使用古老的技术和当地可得的原料制备。这项工作的主要目的是使用具有最小二乘最小二乘回归的中红外光谱法直接测定传统发酵酒精饮料中的乙醇,验证校准模型的鲁棒性并评估饮料的质量。结果使用偏最小二乘回归(MIR-PLS)的中红外光谱法测定了埃塞俄比亚传统发酵酒精饮料中的乙醇含量。通过850–1200?cm ?1 的32次扫描收集了校准和验证集以及真实样品的光谱。用乙醇(2-10%w / w)和糖(葡萄糖,果糖,蔗糖和麦芽糖)(0-5%w / w)组成的总共25种合成标准品(校准和验证集)用于构建和验证模型。通过交叉验证方法与25个遗漏的标准品对25种不同的校准模型进行了验证。大量的预处理得到了验证,但是最好的预处理是减去最小的α+β二阶导数。发现该模型的校准和交叉验证的确定系数最高(0.999,0.999),并且预测的均方根误差为[0.1%(w / w)]。对于实际相关性,将MIR-PLS预测值与气相色谱法确定的值进行比较。发现该模型的预测值与气相色谱测量结果非常吻合。此外,在加标2.4–6.4%(w / w)乙醇的情况下进行了回收率测试。基于获得的85.4–107%(w / w)的回收率,样品的基质效应不明显。结论发现了拟议的技术,即MIR-PLS在1200-850?cm ?1 光谱区域,适用于定量酒精饮料中的乙醇。在所研究的饮料中(泰拉,Netch泰拉,过滤泰拉,Korefe,Keribo,Borde和Birz),平均乙醇含量为0.77-9.1%(v / v)。发现Tej的乙醇含量最高,而Keribo的乙醇含量最少。所开发的方法简单,快速,准确,准确。而且,根本不需要样品制备。但是,应注意,本程序可能不适用于监管目的(例如控制标签)。

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