Department of Chemistry, Purdue University, West Lafayette, Indiana 47907-2084, USA.
Anal Chem. 2013 Sep 3;85(17):8075-9. doi: 10.1021/ac401935e. Epub 2013 Aug 15.
In Fourier transform mass spectrometry, it is well-known that plotting the spectrum in absorption mode rather than magnitude mode has several advantages. However, magnitude spectra remain commonplace due to difficulties associated with determining the phase of each frequency at the onset of data acquisition, which is required for generating absorption spectra. The phasing problem for electrostatic traps is much simpler than for Fourier transform ion cyclotron resonance (FTICR) instruments, which greatly simplifies the generation of absorption spectra. Here, we present a simple method for generating absorption spectra from a Fourier transform electrostatic linear ion trap mass spectrometer. The method involves time shifting the data prior to Fourier transformation in order to synchronize the onset of data acquisition with the moment of ion acceleration into the electrostatic trap. Under these conditions, the initial phase of each frequency at the onset of data acquisition is zero. We demonstrate that absorption mode provides a 1.7-fold increase in resolution (full width at half maximum, fwhm) as well as reduced peak tailing. We also discuss methodology that may be applied to unsynchronized data in order to determine the time shift required to generate an absorption spectrum.
在傅里叶变换质谱中,众所周知,以吸收模式而不是幅度模式绘制光谱具有几个优点。然而,由于在数据采集开始时确定每个频率的相位存在困难,因此幅度光谱仍然很常见,这是生成吸收光谱所必需的。静电阱的定相问题比傅里叶变换离子回旋共振(FTICR)仪器简单得多,这大大简化了吸收光谱的生成。在这里,我们提出了一种从傅里叶变换静电线性离子阱质谱仪生成吸收光谱的简单方法。该方法涉及在傅里叶变换之前对数据进行时间移位,以便将数据采集的开始与离子加速进入静电阱的时刻同步。在这些条件下,数据采集开始时每个频率的初始相位为零。我们证明,吸收模式提供了 1.7 倍的分辨率(半峰全宽,fwhm)增加以及减少的峰尾。我们还讨论了可能应用于未同步数据的方法,以确定生成吸收光谱所需的时间移位。