Tautomerism and Expert Systems in Spectroscopy, Part II: Assigning the Correct Tautomers Using NMR Spectral Predictors and IR Structure–Spectrum Verification Tools (PDF)

May 1, 2004
Michel R.J. Hachey

Spectroscopy

Spectroscopy, Spectroscopy-05-01-2004,

Because tautomers are closely related structural isomers, it can be difficult to identify distinguishing traits. Specialized software can be used to accelerate the assignment and validation of proposed tautomers.