Ultra Performance Liquid Chromatography Ion Mobility Time-of-Flight Mass Spectrometry Characterization of Naphthenic Acids Species from Oil Sands Process-Affected Water

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• 作者：Rongfu Huang ; Kerry N. McPhedran ; Mohamed Gamal El-Din
• 刊名：Environmental Science & Technology
• 出版年：2015
• 出版时间：October 6, 2015
• 年：2015
• 卷：49
• 期：19
• 页码：11737-11745
• 全文大小：497K
• ISSN：1520-5851

文摘

Ultraperformance liquid chromatography ion mobility time-of-flight mass spectrometry (UPLC-IM-TOFMS), integrating traveling wave ion mobility spectrometry (TWIMS) with negative electrospray ionization (ESI) mode, was used to achieve two-dimensional (2D) separation (drift vs retention times) of naphthenic acids (NAs). Unprocessed and ozonated commercial NAs were used for method development. Only O₂鈥揘As were found in unprocessed NAs with ozonation creating O₃鈥揘As and O₄鈥揘As. Unprocessed and ozonated oil sands process-affected waters (OSPW) were examined to validate the method for complex matrix NAs. Ozonation increased the x number for O_x鈥揘As (2 鈮?x 鈮?5) and also impacted the 鈭?i>Z number distribution. OSPW extracted using dichloromethane removed the potential for sample matrix impacts and was used for MS/MS NAs characterization. The O_x鈥揘As (2 鈮?x 鈮?6) were identified with O₂鈥揘As separated into three clusters indicating isobaric and isomeric species. MS/MS was used to verify compounds, while also indicating the presence of CH₃CH₂S鈥?NAs groups. This result may be useful for future studies of sulfur-NAs fate, toxicity, and treatment. Overall, the value-added information provided by UPLC-IM-TOFMS makes it a promising analytical technique for analysis of NAs in complex OSPW samples. Moreover, this methodology can be used for other matrices to investigate relative molecular sizes and to separate complex species (e.g., fatty acids, lipids), making it beneficial for environmental and bioanalytical applications.