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电化学传感器阵列与化学计量学建模在电子烟中的应用。

Applications of an Electrochemical Sensory Array Coupled with Chemometric Modeling for Electronic Cigarettes.

机构信息

School of Pharmacy, University of Maryland, Baltimore, MD 21201, USA.

出版信息

Sensors (Basel). 2024 Aug 31;24(17):5676. doi: 10.3390/s24175676.

Abstract

This study investigates the application of an eNose (electrochemical sensory array) device as a rapid and cost-effective screening tool to detect increasingly prevalent counterfeit electronic cigarettes, and those to which potentially hazardous excipients such as vitamin E acetate (VEA) have been added, without the need to generate and test the aerosol such products are intended to emit. A portable, in-field screening tool would also allow government officials to swiftly identify adulterated electronic cigarette e-liquids containing illicit flavorings such as menthol. Our approach involved developing canonical discriminant analysis (CDA) models to differentiate formulation components, including e-liquid bases and nicotine, which the eNose accurately identified. Additionally, models were created using e-liquid bases adulterated with menthol and VEA. The eNose and CDA model correctly identified menthol-containing e-liquids in all instances but were only able to identify VEA in 66.6% of cases. To demonstrate the applicability of this model to a commercial product, a Virginia Tobacco JUUL product was adulterated with menthol and VEA. A CDA model was constructed and, when tested against the prediction set, it was able to identify samples adulterated with menthol 91.6% of the time and those containing VEA in 75% of attempts. To test the ability of this approach to distinguish commercial e-liquid brands, a model using six commercial products was generated and tested against randomized samples on the same day as model creation. The CDA model had a cross-validation of 91.7%. When randomized samples were presented to the model on different days, cross-validation fell to 41.7%, suggesting that interday variability was problematic. However, a subsequently developed support vector machine (SVM) identification algorithm was deployed, increasing the cross-validation to 84.7%. A prediction set was challenged against this model, yielding an accuracy of 94.4%. Altered Elf Bar and Hyde IQ formulations were used to simulate counterfeit products, and in all cases, the brand identification model did not classify these samples as their reference product. This study demonstrates the eNose's capability to distinguish between various odors emitted from e-liquids, highlighting its potential to identify counterfeit and adulterated products in the field without the need to generate and test the aerosol emitted from an electronic cigarette.

摘要

本研究旨在探讨电子鼻(电化学感应阵列)设备作为一种快速且经济有效的筛选工具的应用,用于检测日益流行的假冒电子烟,以及那些添加了潜在有害物质如维生素 E 醋酸酯(VEA)的电子烟,而无需产生和测试这些产品旨在散发的气溶胶。便携式现场筛选工具还将使政府官员能够迅速识别含有非法调味剂如薄荷醇的掺假电子烟液。我们的方法涉及开发规范判别分析(CDA)模型来区分配方成分,包括电子烟液基础液和尼古丁,电子鼻能够准确识别这些成分。此外,还创建了使用掺有薄荷醇和 VEA 的电子烟液基础液的模型。电子鼻和 CDA 模型在所有情况下都正确识别含有薄荷醇的电子烟液,但仅能在 66.6%的情况下识别 VEA。为了展示该模型在商业产品中的适用性,对弗吉尼亚烟草 JUUL 产品进行了掺假处理,添加了薄荷醇和 VEA。构建了 CDA 模型,并在对预测集进行测试时,能够以 91.6%的时间识别掺假薄荷醇的样品,以 75%的尝试识别含有 VEA 的样品。为了测试该方法区分商业电子烟液品牌的能力,使用六个商业产品生成了一个模型,并在模型创建当天与随机样本进行了测试。CDA 模型的交叉验证率为 91.7%。当将随机样本呈现给模型的不同日期时,交叉验证率降至 41.7%,表明日内变异性存在问题。然而,随后开发的支持向量机(SVM)识别算法得到了应用,交叉验证率提高到 84.7%。预测集与该模型进行了挑战,准确率为 94.4%。对艾尔夫酒吧和海德 IQ 配方的改动用于模拟假冒产品,在所有情况下,品牌识别模型都没有将这些样本分类为其参考产品。本研究表明电子鼻能够区分电子烟液发出的各种气味,突出了其在无需产生和测试电子烟发出的气溶胶的情况下在现场识别假冒和掺假产品的潜力。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/c554/11397949/83041aa1d633/sensors-24-05676-g001.jpg

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