Publishers Description
The collection contains 22,503 unreduced HNMR spectra of organic compounds and chemical structures. The data resulted from quality control in combinatorial synthesis and cover a wide range of compound classes.
The chemical shifts of the spectra are assigned to the corresponding atoms in the chemical structures. This is the basis of a powerful spectrumprediction tool. The magnetic field strength is 300 - 500 MHz.
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Keywords
chemical name
chemical structures
HNMR
molecular formula
organic chemistry
organic compounds
solvent
SpecInfo
spectrum prediction
standard condition
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