Application Note: Accelerated deformulation of LC/MS and GC/MS data through database searching
28 September 2020

In this poster, ACD/Labs presents a two-step approach using ACD/MS Workbook Suite and ACD/MS Structure ID to expedite deformulation – firstly, through mass spectral searching of available libraries using LC/MS/MS data and secondly, by follow up screening of any poorly characterized components against structural databases using accurate mass and predicted chemical formula.