Bechmann Matthias, Foerster Hans, Maisel Heidi, Sebald Angelika
Bayerisches Geoinstitut, Universität Bayreuth, D-95440 Bayreuth, Germany.
Solid State Nucl Magn Reson. 2005 May;27(3):174-9. doi: 10.1016/j.ssnmr.2004.11.001.
It is shown that straightforward double-quantum filtered (1)H MAS NMR experiments yield spectral lineshapes that permit to estimate the minimum number of (1)H spins in a cluster. The approach may offer an alternative to multiple-quantum experiments for the characterisation of (1)H spin clusters of moderate size. The duration of the double-quantum excitation period has to be chosen suitably, it is necessary to find a practical compromise between optimum double-quantum filtration efficiency and optimum information content of the spectral lineshapes. Some (1)H MAS NMR experiments on partially deuterated maleic acid are reported as well as numerical simulations.
结果表明,直接的双量子滤波(1)H MAS NMR实验产生的谱线形状能够估算团簇中(1)H自旋的最小数量。该方法可能为表征中等尺寸的(1)H自旋团簇提供一种替代多量子实验的方法。双量子激发期的持续时间必须适当选择,有必要在最佳双量子滤波效率和谱线形状的最佳信息含量之间找到实际的折衷方案。还报道了一些对部分氘代马来酸进行的(1)H MAS NMR实验以及数值模拟。