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β-环糊精中苯基脲衍生物包合物的核磁共振氢谱研究

1H NMR study of inclusion compounds of phenylurea derivatives in beta-cyclodextrin.

作者信息

Dupuy N, Barbry D, Bria M, Marquis S, Vrielynck L, Kister J

机构信息

Systèmes chimiques complexes, (GOAE), UMR 6171, Université de Marseille 3, Avenue escadrille Normandie Niemen, 13397 Marseille Cedex 20, France.

出版信息

Spectrochim Acta A Mol Biomol Spectrosc. 2005 Apr;61(6):1051-7. doi: 10.1016/j.saa.2004.04.031.

DOI:10.1016/j.saa.2004.04.031
PMID:15741102
Abstract

Proton nuclear magnetic resonance spectroscopy ((1)H NMR), which has become an important tool for the study "in situ" of beta-cyclodextrin (beta-CD) complexes, was used to study and structurally characterize the inclusion complexes formed between beta-CD and isoproturon, fenuron, monuron and diuron. The high variation of the chemical shifts from the proton located inside the cavity (H-3, H-5 and H-6) coupled with the non variation of the one located outer sphere of the beta-CD (H-1, H-2 and H-4) provided clear evidence of the inclusion phenomena. Two-dimensional rotating frame Overhauser effect spectroscopy (ROESY) experiments were carried out to further support the proposed inclusion mode.

摘要

质子核磁共振波谱法(¹H NMR)已成为研究β-环糊精(β-CD)配合物“原位”情况的重要工具,用于研究β-CD与异丙隆、非草隆、灭草隆和敌草隆形成的包合物,并对其进行结构表征。位于空腔内的质子(H-3、H-5和H-6)化学位移变化很大,而位于β-CD外球的质子(H-1、H-2和H-4)化学位移不变,这为包合现象提供了明确证据。进行了二维旋转框架奥弗豪泽效应光谱(ROESY)实验,以进一步支持所提出的包合模式。

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