Department of Electronic Science, Fujian Provincial Key Laboratory of Plasma and Magnetic Resonance, Biomedical Intelligent Cloud Research and Development Centre, Xiamen University, Xiamen, 361005, China.
Department of Chemistry and Molecular Biology, and Swedish NMR Centre, University of Gothenburg, Box 465, Gothenburg, 40530, Sweden.
Chem Commun (Camb). 2023 May 2;59(36):5475-5478. doi: 10.1039/d2cc06682c.
Nuclear magnetic resonance (NMR) spectroscopy has become a formidable tool for biochemistry and medicine. Although -coupling carries essential structural information it may also limit the spectral resolution. Homonuclear decoupling remains a challenging problem. In this work, we introduce a new approach that uses a specific coupling value as prior knowledge, and the Hankel property of the exponential NMR signal to achieve broadband heteronuclear decoupling using the low-rank method. Our results on synthetic and realistic HMQC spectra demonstrate that the proposed method not only effectively enhances resolution by decoupling, but also maintains sensitivity and suppresses spectral artefacts. The approach can be combined with non-uniform sampling, which means that the resolution can be further improved without any extra acquisition time.
核磁共振(NMR)波谱已经成为生物化学和医学领域的有力工具。尽管 耦合携带重要的结构信息,但它也可能限制光谱分辨率。同核去耦仍然是一个具有挑战性的问题。在这项工作中,我们引入了一种新的方法,该方法使用特定的耦合值作为先验知识,并利用指数 NMR 信号的汉克尔性质,通过低秩方法实现宽带异核去耦。我们在合成和真实 HMQC 谱上的结果表明,所提出的方法不仅通过去耦有效地提高了分辨率,而且保持了灵敏度并抑制了光谱伪影。该方法可以与非均匀采样相结合,这意味着可以在不增加额外采集时间的情况下进一步提高分辨率。