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Accurate prediction of 1H and 13C NMR spectra from a chemical structure. Prediction of other nuclides is also available. .

Mnova NMRPredict Desktop allows Prediction of 1D (1H, 13C, 15N, 19F, 31P, 17O, 29Si) and HSQC from molecular structure (mol file, ChemDraw, IsisDraw, ChemSketch) within Mnova. Easily combine and compare experimental and predicted data as part of your workflow and leverage your company’s unique knowledge. Make better decisions faster!

Info you may need

How to...

To use Mnova NMRPredict Desktop you will need to.

You need Mnova NMR in order to use NMRPredict.

Why update

 By renewing the Updates & Support Package you will be able to update your license to any new release of Mnova for a year. You will also be granted free technical support.


Help and Publications

Have a look at the resources page for this plugin where you will find information as:
  • How to install and activate the software
  • Starting Guides
  • Tutorials
  • Recorded and upcoming webinars
Check out the publications and documents related to this software.


13C NMR Prediction

Prediction of 13C NMR chemical shifts is carried out in Mnova NMRPredict using two different procedures which are then combined by means of the so called ´Best´ prediction.

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1H NMR Prediction

Prediction of 1H NMR spectra follows a similar approach to the case of 13C spectra.

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