Nature Communications (Nov 2017)

Deconvoluting interrelationships between concentrations and chemical shifts in urine provides a powerful analysis tool

  • Panteleimon G. Takis,
  • Hartmut Schäfer,
  • Manfred Spraul,
  • Claudio Luchinat

DOI
https://doi.org/10.1038/s41467-017-01587-0
Journal volume & issue
Vol. 8, no. 1
pp. 1 – 12

Abstract

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The NMR chemical shifts of a substance in urine strongly depend on the composition of the mixture itself, and this makes automatic assignment for quantification very difficult. Here the authors show the chemical shifts of signals and the concentration of NMR-invisible inorganic ions in urine, are predictable.