NMRPredict

Introduction Since the very first release of Mnova, we have been (and still are!) very fortunate to include in the software the prediction of NMR spectra […]

The Auto Assignment Algorithm of Mnova, combines several software techniques we had developed in recent years as tools for expert tasks such as automatic detection and characterization of spectral peaks, automatic solvent detection and automatic structure verification.

use Predict&Compare (or Predict&Verify) to carry out your assignments. Just open a 1D dataset with a molecular structure and follow the menu ‘Analysis/Predict&Compare’.

(Updated on December 9th, 2021) Running Predictions Import a molecular structure. Currently, molecular structures can be imported as a .mol file by simply using the Open […]

This feature will display, in stacked mode, a simulated spectrum for the molecular structure present in the spectral window, highlighting the expected chemical shifts when the […]