Bangma Jacqueline T, Reiner Jessica, Fry Rebecca C, Manuck Tracy, McCord James, Strynar Mark J
Oak Ridge Institute for Science and Education, Oak Ridge, Tennessee 37831, United States.
Chemical Sciences Division, Hollings Marine Laboratory, National Institute of Standards and Technology, 331 Fort Johnson Road, Charleston, South Carolina 29412, United States.
Environ Sci Technol Lett. 2021 Nov 19;8(12):1085-1090. doi: 10.1021/acs.estlett.1c00901.
The investigation of per- and polyfluorinated alkyl substances (PFAS) in environmental and biological samples relies on both high- and low-resolution mass spectrometry (MS) techniques. While high-resolution MS (HRMS) can be used for identification and quantification of novel compounds, low-resolution MS is the more commonly used and affordable approach for studies examining previously identified PFAS. Of note, perfluorobutanoic acid (PFBA) is one of the smaller PFAS observed in biological and environmental samples and has only one major MS/MS transition, preventing the use of qualitative transitions for verification. Recently, our laboratories undertook a targeted investigation of PFAS in the human placenta from high-risk pregnancies utilizing low-resolution, targeted MS/MS. Examination of placental samples revealed a widespread (n = 93/122 (76%)) chemical interferent in the quantitative ion channel for PFBA (213 → 169). PFBA concentrations were influenced by up to ∼3 ng/g. Therefore, additional chromatographic and HRMS/MS instrumentation was utilized to investigate the suspect peak and putatively assign the identity of the interfering compound as the saturated oxo-fatty acid (SOFA) 3-oxo-dodecanoic acid.
对环境和生物样本中全氟和多氟烷基物质(PFAS)的研究依赖于高分辨率和低分辨率质谱(MS)技术。虽然高分辨率质谱(HRMS)可用于新化合物的鉴定和定量,但低分辨率质谱是研究先前已鉴定的PFAS时更常用且更经济实惠的方法。值得注意的是,全氟丁酸(PFBA)是在生物和环境样本中观察到的较小的PFAS之一,并且只有一个主要的MS/MS跃迁,这使得无法使用定性跃迁进行验证。最近,我们的实验室利用低分辨率靶向MS/MS对高危妊娠孕妇的胎盘进行了PFAS的靶向研究。对胎盘样本的检测发现,PFBA(213 → 169)的定量离子通道中存在广泛的(n = 93/122(76%))化学干扰物。PFBA浓度受到高达约3 ng/g的影响。因此,利用额外的色谱和HRMS/MS仪器对可疑峰进行了研究,并初步确定干扰化合物的身份为饱和氧代脂肪酸(SOFA)3-氧代十二烷酸。