LI Yi-xiao,CHEN Su-wei,ZHOU Chun,HU Ping,XIAO Xue,ZHANG Hong-yang.Screening and Detection of Three Antiviral Drugs Based on UPLC-Q-TOF-MS/MS and Automatic Interpretation Algorithm[J].Journal of Instrumental Analysis,2025,44(12):2462-2469.
LI Yi-xiao,CHEN Su-wei,ZHOU Chun,HU Ping,XIAO Xue,ZHANG Hong-yang.Screening and Detection of Three Antiviral Drugs Based on UPLC-Q-TOF-MS/MS and Automatic Interpretation Algorithm[J].Journal of Instrumental Analysis,2025,44(12):2462-2469. DOI: 10.12452/j.fxcsxb.250304144.
Screening and Detection of Three Antiviral Drugs Based on UPLC-Q-TOF-MS/MS and Automatic Interpretation Algorithm
This study developed a method for rapid analysis of nirmatrelvir,ritonavir and oseltamivir based on ultra-high performance liquid chromatography-quadrupole-time-of-flight tandem mass spectrometry(UPLC-Q-TOF-MS/MS) technique. The MS/MS fragmentation mechanisms for these three antiviral drugs were studied in detail. An automatic interpretation algorithm built by machine learning enables standard-independent identification,with 100% detection rate even at 1% spiked level in serum. It showed sufficient recognition ability for low-abundance fragment ions. The system could effectively distinguish target compounds from matrix interferences. It demonstrated good specificity in the model test. Using this method,nirmatrelvir,ritonavir,and oseltamivir were successfully separated and identified in real drug samples with matching scores all above 85. This study thus provides new ideal and technical support for the quality supervision of antiviral drugs.
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