Automated Solution for Chemical Reaction Optimization

The reaction optimization analysis is fully customizable to fit your needs, including input, data processing, analysis, reporting, and results archiving.​

Analysis options allow you to:​

• Track or ignore specific components​
• Match compounds by structure or retention times​
• Set analysis thresholds and controls​

All settings can be saved, shared, and reused, enhancing efficiency and robustness.

Analysis criteria can be defined by experts and colored flags configured to get warnings when sample analysis does not fulfill the specified requirements. For instance, a sample can be flagged when no peaks are detected, when component peaks overlap, and/or when RT variation exceeds an acceptable threshold.

Detecting these non-conformances is crucial to keep control over results quality. You can review the flagged sample in the Result Viewer to investigate the problem, easily correct peak assignments if needed, and re-analyze samples to update the results.

Chrom Reaction Optimization simplifies decision making by generating global and graphical reports with the analysis results. Reports are generated in multiple formats, including a dynamic html format that allows data sorting (increasing or decreasing order) and export to new reports.

Quantities of reaction starting materials, products, and other declared compounds are graphically represented in charts making it easier to decide on the best reaction conditions at a glance!