吸附
范德瓦尔斯力
化学
萃取(化学)
密度泛函理论
氢键
共价键
色谱法
有机化学
分子
计算化学
作者
Yongqing Zhang,Zhen Fan,Xiaolong Shang,Ao L,Miao Liu,Feng Lin,Baoguo Sun,Dong Wei,Xiaotao Sun,Yanfei Xiong,Bo Deng
标识
DOI:10.1111/1750-3841.70215
摘要
ABSTRACT Developing a rapid, efficient, and environmentally friendly analytical methodology for the determination of aromatic esters (AREs) in Baijiu presents a significant challenge. In this study, we developed a room‐temperature method to synthesize core‐shell Fe 3 O 4 @TPB‐Dha in 1 h using pre‐prepared Fe 3 O 4 nanoparticles, enabling rapid and sensitive detection of AREs. The Fe 3 O 4 @TPB‐Dha demonstrated exceptional adsorption capabilities (52.63–58.82 mg/g) with a brief adsorption duration (4 min) for four AREs as magnetic solid phase extraction (MSPE) adsorbent. Moreover, density functional theory (DFT) calculations revealed the key adsorption mechanisms to be hydrogen bonds, van der Waals forces, and π–π interactions. Ultimately, the method enabled the rapid and accurate quantification of the four AREs in real Baijiu samples, with concentrations spanning from 0.17 ± 6 × 10 −4 to 2.40 ± 0.03 mg/L, and exhibited relative standard deviations below 6.57% ( n = 3). These findings suggest that Fe 3 O 4 @TPB‐Dha holds promise as an effective adsorbent for efficient extraction and precise quantification of aromatic esters in Baijiu.
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