MS Structure ID
Characterize Samples and Identify Unknown Components
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Deconvolute LC/mS and GC/MS data for complex samples and identify unknown components. Search proprietary and commercial databases for candidate compounds. ACD/MS Structure ID Suite offers a simple, replicable workflow for generating and narrowing down structural candidates.
- Deconvolute complex LC/MS and GC/MS data into individual component traces
- Search proprietary and commercial databases for spectral matches
- Search PubChem for accurate-mass and molecular-formula matches
- Narrow down candidate structures by retention time and fragment include/exclude lists
Brochures
Deformulate and identify MS components
In this flyer, ACD/Labs demonstrates how the MS Structure ID Suite can help you to deconvolute data and search for structures by mass to identify knowns and unknowns in complex mixtures.
Workflow for chemical characterization and database curation for LC/MS and GC/MS data
In this application note, ACD/Labs outlines a comprehensive workflow for chemical characterization and database curation using LC-MS and GC-MS data.
