The Identification of Acetic Acid-Ethanol Mixture Using Gas Sensor Array and Ensemble Regression

S. Suprapto, Y. Ni'mah, Harmami Harmami, I. Ulfin, Annisa Ardiyanti
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Abstract

Identification of acetic acid-ethanol mixtures using a commercial gas sensor array equipped with ensemble regression has been carried out. The gas sensor analysis was simple, rapid, and fast since it did not require any sample preparation. A quantitative analysis of the acetic acid-ethanol mixture was carried out to determine the sensitivity and selectivity of the sensor in distinguishing the concentration of the acetic acid and ethanol mixture. This study focuses on the coefficient of determination of 80% of the calibration data set and recovery of 20% of the testing data set. The models showed excellent performance,specifically, the Bagging and Random Forest r2 for the ethanol calibration data reached 0.91 and 0.94, respectively. The corresponding ethanol test recoveries were 99.95% and 97.84%, indicating the robustness of the model in accurately predicting ethanol concentration. Acetic acid test recoveries were 100.56% and 101.38% with r2 of 0.89 and 0.93 for Bagging and Random Forest regression, respectively. Hence, the commercial gas sensor array equipped with ensemble regression can be applied to the quantification of the acetic acid – ethanol mixture and demonstrate opportunities for the practical use of this gas sensor array in analyzing real samples, i.e. human breath or environmental monitoring samples.
利用气体传感器阵列和集合回归识别醋酸-乙醇混合物
使用配备了集合回归功能的商用气体传感器阵列对醋酸-乙醇混合物进行了鉴定。气体传感器分析简单、快速,无需任何样品制备。对醋酸-乙醇混合物进行了定量分析,以确定传感器在区分醋酸和乙醇混合物浓度方面的灵敏度和选择性。这项研究的重点是 80% 校准数据集的测定系数和 20% 测试数据集的回收率。模型表现出优异的性能,特别是乙醇校准数据的 Bagging 和 Random Forest r2 分别达到 0.91 和 0.94。相应的乙醇测试回收率分别为 99.95% 和 97.84%,表明该模型在准确预测乙醇浓度方面的稳健性。乙酸测试回收率分别为 100.56% 和 101.38%,袋式回归和随机森林回归的 r2 分别为 0.89 和 0.93。因此,配备了集合回归的商用气体传感器阵列可应用于乙酸-乙醇混合物的定量分析,并为该气体传感器阵列在实际样品(即人体呼吸或环境监测样品)分析中的实际应用提供了机会。
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