Predict COSY

Predict 2D NMR COSY (Correlation spectroscopy). Draw your molecule or drop your molfile directly on the editor, then click the simulate button. You can zoom and mouseover everywhere in the graph. If you have an experimental jcamp you may drag and drop it to superimpose the spectrum.

• Banfi, D.; Patiny, L. www.nmrdb.org: Resurrecting and processing NMR spectra on-line Chimia, 2008, 62(4), 280-281.
• Andrés M. Castillo, Luc Patiny and Julien Wist. Fast and Accurate Algorithm for the Simulation of NMR spectra of Large Spin Systems. Journal of Magnetic Resonance 2011.
• Aires-de-Sousa, M. Hemmer, J. Gasteiger, “ Prediction of 1H NMR Chemical Shifts Using Neural Networks”, Analytical Chemistry, 2002, 74(1), 80-90.