Fully Automated Structure Verification of Organic Compounds by Combining High Resolution Accurate MS with NMR Data Analysis

Verification of structures during the drug development process needs to be rapid yet often involves MS/NMR experts. In this application note, a new approach is described which automates structure verification for synthetic chemists. Verification results, for the user, are visualized with a red/yellow/green classification which greatly reduces the number of cases an expert has to become involved.