基于 UV-DOAS 和光谱升级技术的ppb 级呼出丙酮检测光学传感器。

IF 5.6 1区 化学 Q1 CHEMISTRY, ANALYTICAL Talanta Pub Date : 2025-03-18 DOI:10.1016/j.talanta.2025.127965
Fei Xie , Jie Gao , Qi Tian , Changyin Li , Rui Zhu , Shufeng Xu , Mu Li , Yungang Zhang
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引用次数: 0

摘要

检测呼气中丙酮含量的方法为监测糖尿病(DM)提供了一种前景广阔的方法。因此,呼出气体中丙酮的检测备受关注。然而,由于呼出气体成分复杂以及丙酮吸收特征导致的基线漂移,使用紫外差分光学吸收光谱(UV-DOAS)检测呼出气体中丙酮的方法很少被提出。在本研究中,我们提出了一种基于改进型 UV-DOAS 和光谱升级的光学传感器,首次实现了对 200 纳米以下波段呼出气体中丙酮的检测。首先,将 UV-DOAS 的整体拟合过程改进为分段拟合,以解决基线漂移问题,从而得到丙酮的标准差分吸收光谱。其次,提出了一种基于小波系数矩阵的光谱升频浓度反演方法。这有助于通过光谱升频提供的额外时频信息,有效处理氧气 (O2)、氨气 (NH3) 和丙酮之间的光谱重叠。实验室结果表明,我们的传感器的检测限达到了 14.97 ppb∗m,性能卓越。对人体呼出气体样本进行的测试表明,该传感器可检测到 ppb 水平的丙酮,其浓度会随着脂质代谢的增加而上升。我们的光学传感器具有很高的准确性和稳定性,在无创早期糖尿病诊断方面具有巨大的潜力和价值。
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An optical sensor for ppb-level exhaled acetone detection based on UV-DOAS and spectral upscaling
The method of detecting acetone levels in breath presents a promising approach for monitoring diabetes mellitus (DM). Consequently, the detection of acetone in exhaled breath is garnering significant attention. However, using ultraviolet differential optical absorption spectroscopy (UV-DOAS) for detection of the exhaled acetone has rarely been proposed due to the complex composition of exhaled gases and the baseline drift caused by the acetone absorption feature. In this study, we present an optical sensor based on an improved UV-DOAS and spectral upgrading, enabling the detection of exhaled acetone in the sub-200 nm wavelength band for the first time. Firstly, the overall fitting process in the UV-DOAS was improved to segmental fitting to address the issue of baseline drift, resulting in a standard differential absorption spectrum for acetone. Secondly, a spectral upscaling concentration inversion method based on wavelet coefficient matrix is proposed. This helps effectively handle spectral overlaps among oxygen (O2), ammonia (NH3), and acetone through the additional time-frequency information provided by spectral upscaling. Laboratory-based results demonstrate that our sensor achieves a detection limit of 14.97 ppb∗m, representing exceptional performances. Tests on human exhaled breath samples revealed that the sensor can detect acetone at ppb levels, with concentrations rising alongside increased lipid metabolism. Our optical sensor offers high accuracy and stability, demonstrating significant potential and value for non-invasive early diabetes diagnosis.
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来源期刊
Talanta
Talanta 化学-分析化学
CiteScore
12.30
自引率
4.90%
发文量
861
审稿时长
29 days
期刊介绍: Talanta provides a forum for the publication of original research papers, short communications, and critical reviews in all branches of pure and applied analytical chemistry. Papers are evaluated based on established guidelines, including the fundamental nature of the study, scientific novelty, substantial improvement or advantage over existing technology or methods, and demonstrated analytical applicability. Original research papers on fundamental studies, and on novel sensor and instrumentation developments, are encouraged. Novel or improved applications in areas such as clinical and biological chemistry, environmental analysis, geochemistry, materials science and engineering, and analytical platforms for omics development are welcome. Analytical performance of methods should be determined, including interference and matrix effects, and methods should be validated by comparison with a standard method, or analysis of a certified reference material. Simple spiking recoveries may not be sufficient. The developed method should especially comprise information on selectivity, sensitivity, detection limits, accuracy, and reliability. However, applying official validation or robustness studies to a routine method or technique does not necessarily constitute novelty. Proper statistical treatment of the data should be provided. Relevant literature should be cited, including related publications by the authors, and authors should discuss how their proposed methodology compares with previously reported methods.
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