Most conventional heteronuclear spin-state-selective (S3) NMR experiments only work for a specific multiplicity, typically IS spin systems. Here, we introduce a general and efficient IPAP strategy to achieve S3 editing simultaneously for all multiplicities in the acquisition dimension of the HSQC experiment. Complementary in-phase (HSQC-IP) and anti-phase (HSQC-AP) data are separately recorded with a simple phase exchange of two 90° proton pulses involved in the mixing process of the F2-coupled sensitivity-improved HSQC pulse sequence. Additive and subtractive linear combination of these IP/AP data generates simplified F2-α/β-spin-edited HSQC subspectra for all IS, I2S, and I3S spin systems and combines enhanced and optimized sensitivity with excellent tolerance to unwanted cross-talk contributions over a considerable range of coupling constants. Practical aspects such as pulse phase settings, transfer efficiency dependence, inter-pulse delay optimization, and percentage of cross-talk are theoretically analyzed and discussed as a function of each InS multiplicity. Particular emphasis on the features associated to spin-editing in diastereotopic I2S spin systems and application to the measurement of long-range proton-carbon coupling constants are also provided. © 2006.
|Journal||Journal of Magnetic Resonance|
|Publication status||Published - 1 May 2006|
- Coupling constants
- Spin-state selection
Nolis, P., Espinosa, J. F., & Parella, T. (2006). Optimum spin-state selection for all multiplicities in the acquisition dimension of the HSQC experiment. Journal of Magnetic Resonance, 180(1), 39-50. https://doi.org/10.1016/j.jmr.2006.01.003