Features & Capabilities

Fast and accurate NMR spectra prediction.

App to predict ¹³C and ¹H NMR spectra: draw a structure to see its spectra. The accuracy (Mean Average Error) of the algorithm is about 1.5 ppm for ¹³C and 0.21 ppm for ¹H (RMSE = 2.8 and 0.31 ppm correspondingly).

  • Instantly re-calculate spectra while changing structure;
  • Predicted spectra stored in iCloud and synchronised among all iOS devices and Mac version;
  • Email PDF report;
  • Zoom in spectrum;
  • Zoom in structure (important for iPhone users);
  • Option to display chemical shift values on structure;
  • Simple clean interface.

The prediction algorithm is a combination of neural network and spheric codes based algorithms.

User Growth & Download Statistics

App
By:
Kirill Blinov
Rating:
5.00
(3)
5.00
Version:
3.0 Last updated: 2025-10-12
Version code:
878836137
Creation date:
2015-04-23
Compatible devices:
Size:
142.69MB
URLs:
Website ,Privacy policy
Full description:
See detailed description
Source:
Apple Apps Store
Data ingested on:
2026-06-06
Compare stats and ranking:

Contact the developer

Chrome-Stats does not own this Apple app. Please use these information below to contact the Apple app developer.
Developed by:
Kirill Blinov
Apple Apps Store
https://apps.apple.com/us/app/all-nmr/id808434461
Website:
http://www.moleculeapps.com/NMRPredictionFull.html

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