Demos > Simulate NMR and MS
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For unrestricted access to this online tool, please log into ChemDoodle Mobile in your browser using your ChemDoodle license. ChemDoodle licenses may be obtained in our store, which will also give you access to our desktop software: ChemDoodle 2D and ChemDoodle 3D.
This demo will simulate 1H and 13C NMR spectra, as well as the mass spectrum parent peak (isotopic distribution), of the molecule you draw in the sketcher. Click the Simulate Spectra button to simulate the spectra when you finish drawing your molecule. The spectra are interactive, so you can change their perspectives. For more simulation options, atom assignments and publishing features, use ChemDoodle 2D.
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Zoom In: click+drag Zoom Out: double-click Slide: shift+drag Scale: scroll (mousewheel) |
