Complete 1H, 13C{1H}, and 31P NMR spectral parameters of some pyrophosphates

被引：5
|
作者：
Haapaniemi, Esa [1 ]
机构：
[1] Univ Jyvaskyla, Dept Organ Chem, FIN-40500 Jyvaskyla, Finland
来源：
MAGNETIC RESONANCE IN CHEMISTRY | 2017年 / 55卷 / 09期
关键词：
NMR; H-1; C-13{H-1}; P-31; pyrophosphates; iterative spectral analysis; molecular modeling; CHEMICAL WEAPONS CONVENTION; SPECTROSCOPY; PHOSPHORUS;
D O I：
10.1002/mrc.4590
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
The H-1, C-13{H-1}, and P-31 NMR spectral parameters of some pyrophosphates were determined in CDCl3. The most complicated H-1 spectrum can be solved fully only as (A(3)MN)R6XXR6(MNA(3)), where R-6 (= ?N(CH3)(2)) is coupled only to phosphorus (X). Second-order coupling between phosphorus was found and solved with iterative analysis. A signal shape of one of the carbon resonance cannot be explained only with couplings. Explanation for exceptional shape was searched from molecular modeling results. Copyright (c) 2017 John Wiley & Sons, Ltd.
引用
收藏
页码：804 / 812
页数：9
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