Effect of the static magnetic field strength on parahydrogen induced polarization NMR spectra. 2009

Sabine Bouguet-Bonnet, and Francesca Reineri, and Daniel Canet
Méthodologie RMN (CMR2, UMR CNRS-UHP 7036), Faculté des Sciences et Techniques, Nancy-Université, BP 239, 54506 Vandoeuvre-lés-Nancy Cedex, France.

Spin polarization transfer from parahydrogen (p-H(2)) to another molecular entity is generally thought to be mediated by longitudinal spin order (represented by the operator product I(z)(A)I(z)(B), A and B being the two hydrogen nuclei which originate from p-H(2) after a hydrogenation reaction). The longitudinal spin order leads to antiphase patterns in the proton NMR spectrum. In addition to these antiphase patterns, in-phase patterns, arising from polarization differences (represented by (I(z)(A)-I(z)(B))), have been experimentally observed. A complete theory, based on a density operator treatment, has been worked out and applied to the two types of parahydrogen induced polarization experiments: PASADENA (PArahydrogen and Synthesis Allow Dramatically Enhanced Nuclear Alignment; hydrogenation reaction inside the NMR magnet) and (ALTADENA) (Adiabatic Longitudinal Transport After Dissociation Engenders Nuclear Alignment; hydrogenation reaction outside the NMR magnet). It is shown that polarization differences are always created in the case of a PASADENA experiment but that their amplitude depends critically on the ratio of the J coupling over the frequency difference between A and B. In the case of an ALTADENA experiment, if the sample is slowly transferred toward the NMR magnet, polarization differences are definitely created and their amplitude can be larger than the amplitude of the longitudinal spin order. Some test experiments demonstrate the validity of the proposed theory.

UI MeSH Term Description Entries
D009682 Magnetic Resonance Spectroscopy Spectroscopic method of measuring the magnetic moment of elementary particles such as atomic nuclei, protons or electrons. It is employed in clinical applications such as NMR Tomography (MAGNETIC RESONANCE IMAGING). In Vivo NMR Spectroscopy,MR Spectroscopy,Magnetic Resonance,NMR Spectroscopy,NMR Spectroscopy, In Vivo,Nuclear Magnetic Resonance,Spectroscopy, Magnetic Resonance,Spectroscopy, NMR,Spectroscopy, Nuclear Magnetic Resonance,Magnetic Resonance Spectroscopies,Magnetic Resonance, Nuclear,NMR Spectroscopies,Resonance Spectroscopy, Magnetic,Resonance, Magnetic,Resonance, Nuclear Magnetic,Spectroscopies, NMR,Spectroscopy, MR
D012015 Reference Standards A basis of value established for the measure of quantity, weight, extent or quality, e.g. weight standards, standard solutions, methods, techniques, and procedures used in diagnosis and therapy. Standard Preparations,Standards, Reference,Preparations, Standard,Standardization,Standards,Preparation, Standard,Reference Standard,Standard Preparation,Standard, Reference
D004574 Electromagnetic Fields Fields representing the joint interplay of electric and magnetic forces. Electromagnetic Field,Field, Electromagnetic,Fields, Electromagnetic
D006859 Hydrogen The first chemical element in the periodic table with atomic symbol H, and atomic number 1. Protium (atomic weight 1) is by far the most common hydrogen isotope. Hydrogen also exists as the stable isotope DEUTERIUM (atomic weight 2) and the radioactive isotope TRITIUM (atomic weight 3). Hydrogen forms into a diatomic molecule at room temperature and appears as a highly flammable colorless and odorless gas. Protium,Hydrogen-1

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