Compound Discoverer 3.0 Software - Small Molecule Data Analysis
Sample to structure; pathways to insight
You have large amounts of data from full scan MS systems from which you have to efficiently extract high-confidence understanding without need for an expert user. Introducing the Thermo Scientific Compound Discoverer 3.0 software, which 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.
Quick links
| Reduce the number of mouse clicks | Know your unknowns | Find real differences in your sample sets | Understand biological pathways |
|---|---|---|---|
| Take control of your data 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 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. |
Learn how it works
Explore Compound Discoverer 3.0 software, the complete small molecule identification and characterization solution.
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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
Learn more
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.
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We’re here to help you maximize your free trial of Compound Discoverer software. Contact us if you would like more information on how to use it, or if you’d like to have a representative contact you.
