Published September 22, 2023
| Version v1
Dataset
Open
Dataset for publication: Supporting the assignment of NMR spectra with variable-temperature experiments
Authors/Creators
- 1. Centre of New Technologies, University of Warsaw, Banacha 2C, Warsaw, 02-097, Poland
Description
1. The raw one- and two-dimensional NMR data for Products (1-7) listed in the article (Agilent 700 MHz).
2. The raw 1D variable-temperature NMR data for Products 1-7 (Agilent 700 MHz).
3. The 1D variable-temperature NMR data converted into a Bruker format to open in the Radon peak-picker, Radon peak-picker Python script (picker.py), and trained neural network model (model) folder. To open the Radon peak-picker see the Manual from: https://doi.org/10.1016/j.jmro.2022.100083