Anwendung von Computern bei der Strukturaufklärung organischer Verbindungen mit Hilfe spektroskopischer Methoden

Abstract

A system for computer-aided identification of organic compounds by means of spectroscopic methods is described. The unkonwn spectra are compared with a library of reference spectra. A highly flexible software automatically selects the appropriate search strategy and directs the updating of the library, thereby ensuring continous adaption to varying needs.