ACD/MS Structure ID Suite from ACD/Labs

Description

Software for deformulating and identifying unknowns from GC/MS and LC/MS data.

Features
  • Identify unknown components by spectral and mass search
  • Get greater confidence in unknown identification with fragment and retention time prediction
  • Filter component search results by fragment include and exclude lists
  • Automatically annotate mass spectra with adducts, fragments, etc.
  • Compatible with data from all major instrument vendor