阳离子聚合
化学
吸附
共价键
氢键
残留物(化学)
密度泛函理论
离子键合
检出限
羧酸
纳米颗粒
色谱法
组合化学
有机化学
分子
纳米技术
计算化学
材料科学
离子
作者
Lu Liu,Xiaoxing Wang,Liu Feng,Guiju Xu,Jin‐Ming Lin,Minglin Wang,Yongning Wu,Rusong Zhao,Xia Wang
出处
期刊:Food Chemistry
[Elsevier BV]
日期:2022-02-09
卷期号:383: 132396-132396
被引量:22
标识
DOI:10.1016/j.foodchem.2022.132396
摘要
• A fast and sensitive method was established for the determination of PCAs. • A functional TpTG Cl with abundant positive charge, N/O groups was prepared. • An in-depth understanding of adsorption mechanism was elucidated by DFT study. • This d-SPE technique was used to quantify PCAs in rice and water samples. Development of efficient and sensitive adsorbent for capturing phenoxy carboxylic acids (PCAs) from environmental and food samples is necessary because PCAs could threaten human health. Designing nanoparticle with multiple functional groups is beneficial to achieve the strong adsorption interaction and the specific recognition for target compound. In this paper, TpTG Cl as an ionic covalent organic framework (ICOF), that could offer plenty of positive charges and hydrogen-bonding sites, was fabricated. TpTG Cl achieved quicker, more sensitive enrichment for anionic PCAs. The analysis of binding affinity by density functional theory (DFT) demonstrated that PCAs bonded to TpTG Cl primarily via electrostatic attraction, N H···O and O H···O, and C H···π interaction. The quantitative approach indicated low limits of detection (0.016–0.036 ng·g −1 for rice and 0.43–0.78 ng·L -1 for water). Furthermore, successfully determining PCAs emitted from real samples indicated the applicability of TpTG Cl .
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