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Toward multipurpose NMR experiments
Authors:Judith Schlagnitweit  Gerhard Zuckerstätter  Norbert Müller
Institution:1. Institute of Organic Chemistry, Johannes Kepler University, Altenbergerstra?e 69, 4040 Linz, Austria;2. Kompetenzzentrum Holz GmbH, St.‐Peter‐Stra?e 25, 4021 Linz, Austria
Abstract:Standard phase cycled NMR pulse sequences were generalized such that for each individual step of the pulse phase cycle the free induction decay is stored separately without phase correction. This is in contrast to the usual practice, where pulse responses are phase shifted immediately (by applying a ‘receiver phase’) and co‐added as they are stored. The approach used here allows one to extract different types of NMR information, which are usually referred to as different ‘experiments’, from the same raw data set a posteriori by using complex linear combinations. Storing the free induction decays of individual phase cycle steps separately and using specific linear combinations of these data to obtain a particular type of information increase the overall efficiency of a given set of NMR experiments substantially, because all information can be derived from a single multiplexed data set. This ‘super‐experiment’ requires only as much time as the most complex of the derived specific experiments alone. The principle of this multipurpose approach was demonstrated by performing different multiple‐quantum filtered COSY experiments. It also becomes possible to generate linear combinations, which differ from the conventionally acquired spectra a posteriori. For example, we implemented diagonal peak reduction by using zero‐ and single‐quantum filtered COSY contributions without requiring additional experiment time. Copyright © 2009 John Wiley & Sons, Ltd.
Keywords:NMR  1H  multiplex phase cycles  cogwheel phase cycles  coherence selection  multiple‐quantum filtered COSY  E COSY  diagonal peak reduction
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