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SmartDriveNMR Set-up

Select the desired level of confidence. - Set the allocated maximum spectrometer time. Setting up a structure verification task in IconNMR with SmartDriveNMR: no spectroscopic input required.

Fig2a SmartDriveNMR

Submit the molecular structure, and (if applicable) a quantification reference and known impurities. Setting up a structure verification task in IconNMR with SmartDriveNMR: no spectroscopic input required.

Fig2b SmartDriveNMR

SmartDriveNMR in Action

SmartDriveNMR runs a 1D Proton and then decides whether to acquire further scans, with solvent suppression and/or additional experiments such as multiplicity edited HSQC, 1D13C and HMBC.

Fig3a SmartDriveNMR

SmartDriveNMR Monitor

The status and progress of a SmartDriveNMR run is displayed for each sample in the monitor GUI.

Fig3a SmartDriveNMR

SmartDriveNMR Results

Active decision making on-the-fly saves experiment time – simply considering the structure alone might have demanded an HSQC in both cases.

Top part of figure - SmartDriveNMR: Multiplets are well separated and straightforward to assign → no HSQC needed.

Bottom part of figure - SmartDriveNMR: Multiplets overlap in the CH/CH2 region, HSQC will improve confidence → setup HSQC.

Fig1. SmartDriveNMR