Degradation of carbofuran and acetamiprid in wolfberry by dielectric barrier discharge plasma: Kinetics, pathways, toxicity and molecular dynamics simulation.

Carbofuran and acetamiprid pose the highest residual risk among pesticides found in wolfberries. This study aimed to degrade these pesticides in wolfberries using a multi-array dielectric barrier discharge plasma (DBD), evaluate the impact on safety and quality and explore their degradation mechanism. The results showed that DBD treatment achieved 90.6% and 80.9% degradation rates for carbofuran and acetamiprid, respectively, following a first-order kinetic reaction. The 120 s treatment successfully reduced pesticide contamination to levels below maximum residue limits. Treatment up to 180 s did not adversely affect the quality of wolfberries. QTOF/MS identification and degradation pathway analysis revealed that DBD broke down the furan ring and carbamate group of carbofuran, while replacing the chlorine atom and oxidizing the side chain of acetamiprid, leading to degradation. The toxicological evaluation showed that the degradation products were less toxic than undegraded pesticides. Molecular dynamics simulations revealed the reactive oxygen species (ROS) facilitated the degradation of pesticides through dehydrogenation and radical addition reactions. ROS type and dosage significantly affected the breakage of chemical bonds associated with toxicity (C 4 –O 5 and C 2 –Cl 1). These findings deepen insights into the plasma chemical degradation of pesticides. [Display omitted] • Unqualified data of wolfberry was firstly investigated and as degradation reference. • DBD degraded 90.64% and 80.92% of carbofuran and acetamiprid, respectively. • The degradation was gained atomic-scale insight by molecular dynamics simulations. • Products and toxicity were studied jointly to examine the safety of CP degradation. • ROS caused degradation through dehydrogenation and radical addition reactions. [ABSTRACT FROM AUTHOR]