Solutions for Chemistry – Late stage Functionalization automation of MS driven structure elucidation

Late Stage Functionalization studies aims to synthetize chemical analogs without the need of using intermediate functional groups. In most cases, conditions to synthetize the desired product should be tuned and the analysis of all the obtained data can be quite time consuming. MassChemSite and WebChembase tandem offers a solution to speed up the process by automatizing the data processing and summarizing the extracted information. In this talk we will show an example of C-H late stage functionalization using a set of catalysts and solvents to synthesize halogenation analogs.