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Generally, NMR data are more quantitative and reliable; furthermore, the LC-MS data were acquired at a later date than the NMR data.
At first it was just a report of a throwaway comment accidentally left in a paper's annex: "Emma, please insert NMR data here! where are they?
Emma, please insert NMR data here! where are they?
Their structures were established by MS and NMR data.
NMR data were processed with Mestre-C software.
Relevant 1H NMR data are reported in Table 2.
IR and NMR data reported were obtained at room temperature.
In most cases, raw experimental NMR data files were submitted.
The FCM data corroborated with the NMR data.
The NMR data are consistent with the literature [28].
All NMR data are consistent with similar conformations in solution.
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