Are you open to a new approach for analyzing your mass spectrometry data? If accurate fragmentation data is available in your laboratory, our patented pattern recognition software allows you to visualize your unknown molecule as being composed of underlying small "subfragments" that show how the fragment ions may be related to each other. (See the bisoprolol example below.) This pattern recognition software tool, available as a simple and economical Excel® Add-In, uses the power of mathematics to rapidly transform numerical data into a structure-orientated visual format. The bisoprolol example here took only 25 seconds.
To demonstrate how the Excel Add-In can help you to identify unknown analytes, please watch a very simple example of the identification of a fungicide metabolite. See thousands of other examples here, searchable by their Pubchem Compound Identifiers.
The Excel Add-In also includes helpful mass spectrometric functions such as mass(), RDBE(), IsoCalc(), and Baserate() that are active in any Excel workbook. Also included is our new high resolution isotope calculator worksheet that plots the isotope distributions in color based on the selected resolution setting. (Isotope Worksheet).