Structural Elucidation of Agrochemicals and Related Derivatives Using Infrared Ion Spectroscopy.

ABSTRACT: Agrochemicals frequently undergo various chemical and metabolic transformation reactions in the environment that often result in a wide range of derivates that must be comprehensively characterized to understand their toxicity profiles and their persistence and outcome in the environment. In the development phase, this typically involves a major effort in qualitatively identifying the correct chemical isomer(s) of these derivatives from the many isomers that could potentially be formed. Liquid chromatography-mass spectrometry and nuclear magnetic resonance (NMR) spectroscopy are often used in attempts to characterize such environment transformation products. However, challenges in confidently correlating chemical structures to detected compounds in mass spectrometry data and sensitivity/se

SUBMITTER: Vink MJA 

PROVIDER: S-EPMC9671053 | biostudies-literature | 2022 Nov

REPOSITORIES: biostudies-literature