From Mass Spectrum to Molecular Formula:
A New Dimension in Compound Verification

True Isotopic Pattern (TIP) analysis

State-of-the art detection technology enables accurate mass determination  of analytes over a  wide dynamic range and facilitates measurement of accurate isotopic ratios with stability over time, independent of sample concentration.

These expanded capabilities have allowed Bruker to develop a quasi two-dimensional analytical method for better molecular formula determinations using a combination of accurate mass determination with the analysis of the isotopic distribution.  

This SmartFormula approach is unique to Bruker and is a very powerful tool used in the hyper accurate determination of a single molecular formula for the analyte of interest.

The CMC product suite delivers:

• Automated molecular formula determination by electrospray mass spectrometry
• Fast and automated structure verification by Nuclear Magnetic Resonance
• Optimum confidence for small molecule characterization
• Quantitation of compounds

For use in:

• Compound Library QC
• Identification of impurities and degradents
• Yield, Identity, and Purity determinations for synthetic chemists

With options to utilize:

• Bruker’s AVANCE™ III NMR and micrOTOF-Q™ II MS cutting edge technologies
• Automated structure determination using novel X2S Crystal-to-Structure X-ray system (option).