单扫描快速采样方法及其在NMR中的应用

摘要/Abstract

摘要：

单扫描快速采样方法利用空间编码技术，只需单次扫描就能获得二维及多维核磁共振(NMR)谱数据，极大地缩短了二维和多维核磁共振谱的采样时间，有望在NMR领域得到广泛的应用. 该文以离散编码单扫描快速采样方法为例阐明了单扫描快速采样方法的原理，介绍了连续幅度调制、连续相位调制等各种单扫描快速采样新方法及其在NMR领域中的应用，指出了单扫描快速采样方法的局限性，并对其未来发展进行了展望.

关键词: 核磁共振(NMR), 单扫描快速采样, , 空间编码

Abstract:

Single-scan ultrafast method can be used to obtain two-dimensional and multi-dimensional NMR spectra within a single scan via spatially encoding technique, thus greatly shortening the experimental time. It has found wide applications in the NMR field. In this review, the discrete spatially encoding single-scan ultrafast method was taken as an example to elucidate the underlying principles. Some novel single-scan methods such as continuous amplitude-modulated encoding and continuous phase-modulated encoding were discussed. The applications of the single-scan methods were introduced and their limitations were analyzed. The perspective of this technique was briefly discussed.

Key words: NMR, single-scan ultrafast method, spatially encoding

中图分类号:

O482.53

赵明芳, 吴灿, 林玉兰, 蔡淑惠, 陈忠. 单扫描快速采样方法及其在NMR中的应用[J]. 波谱学杂志, 2009, 26(4): 541-559.

ZHAO Ming-Fang, WU Can, LIN Yu-Lan, CAI Shu-Hui, CHEN Zhong. Single-Scan Ultrafast Methods and Their Applications in NMR[J]. Chinese Journal of Magnetic Resonance, 2009, 26(4): 541-559.

参考文献

[1] Purcell E M, Torrey H C, Pound R V. Resonance absorption by nuclear magnetic moments in a solid
[J]. Phys Rev, 1946, 69(1/2): 37-38.

[2] Bloch F, Condit R I, Staub H H. Neutron polarization and ferronmagnetic saturation
[J]. Phys Rev, 1946, 70(1): 474-475.

[3] Aue W P, Bartholdi E, Ernst R R. Two-dimensional spectroscopy. Application to nuclear magnetic resonance
[J]. J Chem Phys, 1976, 64: 2 229-2 246.

[4] Schanda P, Brutscher B. Very fast two-dimensional NMR spectroscopy for real-time investigation of dynamic events in proteins on the time scale of seconds
[J]. J Am Chem Soc, 2005, 127(22): 8 014-8 015.

[5] Barkhuijsen H, Beer D R, Ormondt V D, et al. Retrieval of frequencies, amplitudes, damping factors, and phases from time-domain signals using a linear least-squares procedure
[J]. J Magn Reson, 1985, 61: 465-481.

[6] Stern A S, Li K B, Hoch J C. Modern spectrum analysis in multidimensional NMR spectroscopy: Comparison of linear-prediction extrapolation and maximum-entropy reconstruction
[J]. J Am Chem Soc, 2002, 124(9): 1 982-1 993.

[7] Hoch J C. Maximum entropy signal processing of two-dimensional NMR data
[J]. J Magn Reson, 1985, 64: 436-440.

[8] Kupce E, Freeman R. Projection-reconstruction technique for speeding up multidimensional NMR spectroscopy
[J]. J Am Chem Soc, 2004, 126(20): 6 429-6 440.

[9] Mandelshtam V A, Taylor H S, Shaka A J. Application of the filter diagonalization method to one and- two-dimensional NMR spectra
[J]. J Magn Reson, 1998, 133(2): 304-312.

[10] Kupce E, Freeman R. Frequency-domain Hadamard spectroscopy
[J]. J Magn Reson, 2003, 162(1): 158-165.

[11] Kupce E, Freeman R. Two-dimensional Hadamard spectroscopy
[J]. J Magn Reson, 2003, 162(2): 300-310.

[12] Mansfield P. Spatial mapping of the chemical shift in NMR
[J]. Magn Reson Med, 1984, 1: 370-386.

[13] Frydman L, Scherf T, Lupulescu A. The acquisition of multidimensional NMR spectra within a single scan
[J]. Proc Natl Acad Sci U S A, 2002, 99(25): 15 858-15 862.

[14] Frydman L, Blazina D. Ultrafast two-dimensional nuclear magnetic resonance spectroscopy of hyperpolarized solutions
[J]. Nat Phys, 2007, 3(6): 415-419.

[15] Frydman L, Lupulescu A, Scherf T. Principles and features of single-scan two-dimensional NMR spectroscopy
[J]. J Am Chem Soc, 2003, 125(30): 9 204-9 217.

[16] Shrot Y, Frydman L. Spatial encoding strategies for ultrafast multidimensional nuclear magnetic resonance
[J]. J Chem Phys, 2008, 128(5): 052209.

[17] Mishkovsky M, Frydman L. Interlaced Fourier transformation of ultrafast 2D NMR data
[J]. J Magn Reson, 2005, 173(2): 344-350.

[18] Pelupessy P. Adiabatic single scan two-dimensional NMR spectrocopy
[J]. J Am Chem Soc, 2003, 125(40): 12 345-12 350.

[19] Andersen N S, Kockenberger W. A simple approach for phase-modulated single-scan 2D NMR spectroscopy
[J]. Magn Reson Chem, 2005, 43(10): 795-797.

[20] Tal A, Shapira B, Frydman L. A continuous phase-modulated approach to spatial encoding in ultrafast 2D NMR spectroscopy
[J]. J Magn Reson, 2005, 176(1): 107-14.

[21] Shrot Y, Frydman L. Ultrafast two-dimensional NMR spectroscopy using constant acquisition gradients
[J]. J Chem Phys, 2006, 125(20): 204507.

[22] Giraudeau P, Akoka S. A new detection scheme for ultrafast 2D J-resolved spectroscopy
[J]. J Magn Reson, 2007, 186(2): 352-357.

[23] Giraudeau P, Akoka S. Resolution and sensitivity aspects of ultrafast J-resolved 2D NMR spectra
[J]. J Magn Reson, 2008, 190(2): 339-345.

[24] Bhattacharyya R, Frydman L. Ultrafast solid-state 2D NMR experiments via orientational encoding
[J]. J Am Chem Soc, 2006, 128(50): 16 014-16 015.

[25] Pauli G F. qNMR - A versatile concept for the validation of natural product reference compounds
[J]. Phytochem Anal, 2001, 12(1): 28-42.

[26] Giraudeau P, Remaud G S, Akoka S. Evaluation of ultrafast 2D NMR for quantitative analysis
[J]. Anal Chem, 2009, 81(1): 479-484.

[27] Frydman L, Shapira B. Spatially encoded pulse sequences for the acquisition of high resolution NMR spectra in inhomogeneous fields
[J]. J Magn Reson, 2006, 182(1): 12-21.

[28] Shapira B, Frydman L. Spatial encoding and the acquisition of high-resolution NMR spectra in inhomogeneous magnetic fields
[J]. J Am Chem Soc, 2004, 126(23): 7 184-7 185.

[29] Frydman L. Single-scan multidimensional NMR
[J]. C R Chim, 2006, 9(3/4): 336-345.

[30] Shrot Y, Frydman L. Single-scan 2D DOSY NMR spectroscopy
[J]. J Magn Reson, 2008, 195(2): 226-231.

[31] Mishkovsky M, Frydman L. Sensitivity enhancement in 1D heteronuclear NMR spectroscopy via single-scan inverse experiments
[J]. Chem Phys Chem, 2004, 5(6): 779-786.

[32] Shapira B, Karton A, Aronzon D, et al. Real-time 2D NMR identification of analytes undergoing continuous chromatographic separation
[J]. J Am Chem Soc, 2004, 126(4): 1 262-1 265.

[33] Shrot Y, Frydman L. Single-scan NMR spectroscopy at arbitrary dimensions
[J]. J Am Chem Soc, 2003, 125(37): 11 385-11 396.