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结合傅里叶相位编码和宽带反转以获取J编辑谱。

Combining Fourier phase encoding and broadband inversion toward J-edited spectra.

作者信息

Lin Yulan, Guan Quanshuai, Su Jianwei, Chen Zhong

机构信息

Department of Electronic Science, Fujian Provincial Key Laboratory of Plasma and Magnetic Resonance, State Key Laboratory of Physical Chemistry of Solid Surfaces, Xiamen University, Xiamen 361005, China.

Department of Electronic Science, Fujian Provincial Key Laboratory of Plasma and Magnetic Resonance, State Key Laboratory of Physical Chemistry of Solid Surfaces, Xiamen University, Xiamen 361005, China.

出版信息

J Magn Reson. 2018 Jun;291:1-7. doi: 10.1016/j.jmr.2018.02.021. Epub 2018 Mar 20.

Abstract

Nuclear magnetic resonance (NMR) spectra are often utilized for gathering accurate information relevant to molecular structures and composition assignments. In this study, we develop a homonuclear encoding approach based on imparting a discrete phase modulation of the targeted cross peaks, and combine it with a pure shift experiments (PSYCHE) based J-modulated scheme, providing simple 2D J-edited spectra for accurate measurement of scalar coupling networks. Chemical shifts and J coupling constants of protons coupled to the specific protons are demonstrated along the F and F dimensions, respectively. Polychromatic pulses by Fourier phase encoding were performed to simultaneously detect several coupling networks. Proton-proton scalar couplings are chosen by a polychromatic pulse and a PSYCHE element. Axis peaks and unwanted couplings are complete eradicated by incorporating a selective COSY block as a preparation period. The theoretical principles and the signal processing procedure are laid out, and experimental observations are rationalized on the basis of theoretical analyses.

摘要

核磁共振(NMR)光谱常用于收集与分子结构和组成归属相关的准确信息。在本研究中,我们开发了一种基于对目标交叉峰施加离散相位调制的同核编码方法,并将其与基于纯位移实验(PSYCHE)的J调制方案相结合,提供简单的二维J编辑光谱,用于准确测量标量耦合网络。与特定质子耦合的质子的化学位移和J耦合常数分别沿F1和F2维度展示。通过傅里叶相位编码的多色脉冲用于同时检测多个耦合网络。质子-质子标量耦合通过多色脉冲和PSYCHE元件进行选择。通过纳入一个选择性COSY模块作为准备期,完全消除了轴峰和不需要的耦合。阐述了理论原理和信号处理程序,并在理论分析的基础上对实验观察结果进行了合理化解释。

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