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Proceedings Paper

Computer storage of infrared interpretations of complex substrates
Author(s): Paul Meulman; Ronald W. Sarver
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Paper Abstract

A computer program has been developed that stores IR peak positions with assignments, a fragment name, and an appropriate substructure. The program accommodates simple functional groups or substructures up to 500 atoms. The assignment table is retrievable by many users and is useful for structure verification, report writing, review by others, and as an aid to the interpretation of other spectra. The system was designed to store interpretations for substructures or functional groups with carefully defined substituents that may be part of a larger structure.

Paper Details

Date Published: 31 January 1994
PDF: 2 pages
Proc. SPIE 2089, 9th International Conference on Fourier Transform Spectroscopy, (31 January 1994); doi: 10.1117/12.166654
Show Author Affiliations
Paul Meulman, Upjohn Co. (United States)
Ronald W. Sarver, Upjohn Co. (United States)

Published in SPIE Proceedings Vol. 2089:
9th International Conference on Fourier Transform Spectroscopy
John E. Bertie; Hal Wieser, Editor(s)

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