{"title":"Kinetics and Mechanistic Insights into the Ozonolysis of Limona Ketone.","authors":"Shiyuan Meng, Xiaoxiao Lin, Xiaofeng Tang, Yu Xia, Ziji Ma, Liqin Jin, Christa Fittschen, Wei Liu, Milán Szőri, Béla Fiser, Weijun Zhang","doi":"10.1021/acs.jpca.5c02958","DOIUrl":null,"url":null,"abstract":"<p><p>Limona ketone, as a significant intermediate in the oxidation of limonene, plays a crucial role in environmental and human health impacts. In this article, we present a study on the reaction kinetics and mechanism of ozonolysis of limona ketone. The rate constant for the reaction between limona ketone and ozone was measured under standard conditions of 298 K and atmospheric pressure by the absolute rate method and was determined to be (1.2 ± 0.1) × 10<sup>-16</sup> cm<sup>3</sup> molecule<sup>-1</sup> s<sup>-1</sup>. The reaction products were probed online with a vacuum ultraviolet (VUV) photoionization time-of-flight mass spectrometer and utilized to elucidate the reaction mechanism with the aid of kinetics. The atmospheric lifetime of limona ketone was discussed with the present reaction rate constant of limona ketone with O<sub>3</sub>, combined with the literature-reported rate constants for OH and NO<sub>3</sub> reaction. The present results show that in urban areas with elevated ozone levels, ozonolysis is the primary pathway for the degradation of limona ketone, and its low-volatility organic products could significantly contribute to the formation of secondary organic aerosols.</p>","PeriodicalId":59,"journal":{"name":"The Journal of Physical Chemistry A","volume":" ","pages":""},"PeriodicalIF":2.7000,"publicationDate":"2025-05-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"The Journal of Physical Chemistry A","FirstCategoryId":"1","ListUrlMain":"https://doi.org/10.1021/acs.jpca.5c02958","RegionNum":2,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"CHEMISTRY, PHYSICAL","Score":null,"Total":0}
引用次数: 0
Abstract
Limona ketone, as a significant intermediate in the oxidation of limonene, plays a crucial role in environmental and human health impacts. In this article, we present a study on the reaction kinetics and mechanism of ozonolysis of limona ketone. The rate constant for the reaction between limona ketone and ozone was measured under standard conditions of 298 K and atmospheric pressure by the absolute rate method and was determined to be (1.2 ± 0.1) × 10-16 cm3 molecule-1 s-1. The reaction products were probed online with a vacuum ultraviolet (VUV) photoionization time-of-flight mass spectrometer and utilized to elucidate the reaction mechanism with the aid of kinetics. The atmospheric lifetime of limona ketone was discussed with the present reaction rate constant of limona ketone with O3, combined with the literature-reported rate constants for OH and NO3 reaction. The present results show that in urban areas with elevated ozone levels, ozonolysis is the primary pathway for the degradation of limona ketone, and its low-volatility organic products could significantly contribute to the formation of secondary organic aerosols.
期刊介绍:
The Journal of Physical Chemistry A is devoted to reporting new and original experimental and theoretical basic research of interest to physical chemists, biophysical chemists, and chemical physicists.