Published October 17, 2024 | Version v1

Simulated and Experimental Magnetic Resonance Data of Fentanyl HCl

Description

This data consists of simulations and experimental measurements of solid-state nuclear magnetic resonance (SSNMR) spectroscopy, fast-field cycling (FFC) NMR spectroscopy, and nuclear quadrupole resonance (NQR) spectroscopy of fentanyl HCl. 14N and 35Cl SSNMR data are included as the topspin binary format. 1H FFC NMR data are included as the sdf format. 14N NQR data of both NQR spectra are included as the tnt format. Simulated 14N and 35Cl SSNMR data from QUEST are included in an exported topspin binary format. Simulated 14N SSNMR data from SIMPSON is included in the SIMPSON fid format. Simulated Zeeman-perturbed NQR from SPINACH is included as a csv. In all cases post-processed data are also included in the form of csv files for easy viewing by readers. Each csv typically has the first column as a vector of frequencies and the second column as the processed NMR data.

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