Sample to structure; pathways to insight
You have large amounts of data from full scan mass spectrometry from which you have to efficiently extract high-confidence understanding without need for an expert user; introducing Thermo Scientific Compound Discoverer 3.0 software. This mass spectrometry data analysis software offers a full suite of tools to address your challenges with small molecule data analysis. The software streamlines unknown identification, determination of real differences between samples, and elucidation of biological pathways.
|Reduce the number of mouse clicks||Know your unknowns||Find real differences in your sample sets||Understand biological pathways|
|Take control of your mass spectrometry data analysis and processing with custom workflows, flexible visualization, grouping tools, and interactively linked displays. You can also transfer your results with customizable reporting to share with others.||Identify your unknowns more rapidly with mass spectral library searching against both the online mzCloud™ spectral library and in-house Thermo Scientific mzVault spectral libraries.||Quickly find real statistical differences between sample sets. See trends in components across a study or identify the key components of interest between multiple sample groups using interactively linked displays.||Perform metabolic flux experiments, view pathways using Thermo Scientific Metabolika, KEGG, and BioCyc databases, and map detected compounds and flux information to pathways.|
Watch video on how Compound Discoverer software works
Explore Compound Discoverer 3.0 software, the complete small molecule identification and characterization solution.
How Compound Discoverer is used in various applications
Calculate statistical differences between multiple sample sets. Identify impurities, metabolites and degradation products in complex samples.
Analyze the metabolic fate and structural composition of food impurities and degradation products. Detect environmental contaminants in soil and water.
Identify related components in biological samples and determine their structures to quickly isolate metabolites of interest.
Detect unknown metabolites of drugs of abuse and structurally related designer drugs.
* For Forensic Use Only
Ordering guide for Compound Discoverer software
In this white paper we address the challenges in small molecule identification with mass spectral libraries. mzCloud spectral libraries and mzVault software are designed to address the challenges of small molecule identification for routine and research applications.
Related software applications and technology
One resource for all your support needs related to mass spectrometry instruments and software. Obtain relevant technical information, view tips and tricks when starting an experiment, and/or find answers to some common problems.