Ion Mobility Results for PET, Temperature Dependent Data - obtained using the MALDI-Sector instrument

ATDs for the PET 3-mer cationized by Li+, Na+, and K+ obtained at drift cell temperatures of 80 K and ~550 K. For Li+PET3, two peaks appear in both ATDs, although the resolution is somewhat lower in the 550 K ATD, with the same relative peak intensities. For Na+PET3, two peaks appear in the 80 K ATD that are separated by ~25 μs (corresponding to a difference in cross-section of 20 ± 2 Å2) but only one peak is present in the 560 K ATD. Thus, the two conformers that are separated at 80 K must be rapidly isomerizing in the drift cell at higher temperatures, yielding a single, time-averaged peak in the ATD (see 3-mer dynamics section). For K+PET3, one peak appears in both ATDs, indicating that if multiple conformers are present they are still rapidly isomerizing in the drift cell at 80 K.