A Vacuum Ultraviolet Photoionization Mass Spectrometric Study of Propylene Oxide in the Photon Energy Region of 10-40 eV

The photoionization and dissociative photoionizations of propylene oxide have been studied both experimentally and theoretically. In experiments, photoionization efficiency spectra for ions C₃H₆O⁺, C₂H₃O⁺, CH₃O⁺, CH₂O⁺, CHO⁺, C₂H₄⁺, C₂H₃⁺, C₂H₂⁺, CH₃⁺, and CH₂⁺ were obtained. Theoretically, the energetics of the dissociative photoionizations were examined by ab initio Gaussian-2 calculations. The computational results are useful in our attempt to establish the dissociation channels near the ionization thresholds. The dissociation channels we propose include simple bond cleavage reactions as well as reactions involving intermediates and transition structures.

© 1999 American Chemical Society