13C-Formate as an indirect low-temperature 1H lineshape polarimeter

1H polarization quantification is important for dissolution-dynamic nuclear polarization (dDNP) but can be cumbersome due to the requirement of acquiring thermal equilibrium signals and measurements that are complicated by large background signals. 1H nuclear magnetic resonance (NMR) spectra can als...

Full description

Saved in:
Bibliographic Details
Main Authors: Stuart J. Elliott, Quentin Stern, Sami Jannin
Format: Article
Language:English
Published: Elsevier 2024-12-01
Series:Journal of Magnetic Resonance Open
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S2666441024000177
Tags: Add Tag
No Tags, Be the first to tag this record!
_version_ 1850061512543043584
author Stuart J. Elliott
Quentin Stern
Sami Jannin
author_facet Stuart J. Elliott
Quentin Stern
Sami Jannin
author_sort Stuart J. Elliott
collection DOAJ
description 1H polarization quantification is important for dissolution-dynamic nuclear polarization (dDNP) but can be cumbersome due to the requirement of acquiring thermal equilibrium signals and measurements that are complicated by large background signals. 1H nuclear magnetic resonance (NMR) spectra can also be deleteriously influenced by line distortions linked with radiation damping from 1H DNP and cannot be used for accurate calculation of 1H polarization. Determining 1H polarization via immediate 13C lineshape analysis of a simple molecule removes such complications. We present 13C-sodium formate as a straightforward system for indirect 1H polarimetry. The 13C NMR spectra acquired under dDNP conditions have distinct features that are readily reproduced with 13C lineshape simulations. 1H polarizations built-up during 1H DNP were indirectly inferred by fitting simulations to 13C lineshapes. We provide the MATLAB scripts used for 13C lineshape analysis in order that the method can be readily implemented in other laboratories.
format Article
id doaj-art-56451db4c6404063ba23a29559ab29cc
institution DOAJ
issn 2666-4410
language English
publishDate 2024-12-01
publisher Elsevier
record_format Article
series Journal of Magnetic Resonance Open
spelling doaj-art-56451db4c6404063ba23a29559ab29cc2025-08-20T02:50:13ZengElsevierJournal of Magnetic Resonance Open2666-44102024-12-012110016210.1016/j.jmro.2024.10016213C-Formate as an indirect low-temperature 1H lineshape polarimeterStuart J. Elliott0Quentin Stern1Sami Jannin2Corresponding author.; Universite Claude Bernard Lyon 1, CRMN UMR-5280, CNRS, ENS Lyon, Villeurbanne 69100, FranceUniversite Claude Bernard Lyon 1, CRMN UMR-5280, CNRS, ENS Lyon, Villeurbanne 69100, FranceUniversite Claude Bernard Lyon 1, CRMN UMR-5280, CNRS, ENS Lyon, Villeurbanne 69100, France1H polarization quantification is important for dissolution-dynamic nuclear polarization (dDNP) but can be cumbersome due to the requirement of acquiring thermal equilibrium signals and measurements that are complicated by large background signals. 1H nuclear magnetic resonance (NMR) spectra can also be deleteriously influenced by line distortions linked with radiation damping from 1H DNP and cannot be used for accurate calculation of 1H polarization. Determining 1H polarization via immediate 13C lineshape analysis of a simple molecule removes such complications. We present 13C-sodium formate as a straightforward system for indirect 1H polarimetry. The 13C NMR spectra acquired under dDNP conditions have distinct features that are readily reproduced with 13C lineshape simulations. 1H polarizations built-up during 1H DNP were indirectly inferred by fitting simulations to 13C lineshapes. We provide the MATLAB scripts used for 13C lineshape analysis in order that the method can be readily implemented in other laboratories.http://www.sciencedirect.com/science/article/pii/S2666441024000177NMRHyperpolarizationDNP, dDNP1H spin polarizationLineshape polarimetry13C-Sodium formate
spellingShingle Stuart J. Elliott
Quentin Stern
Sami Jannin
13C-Formate as an indirect low-temperature 1H lineshape polarimeter
Journal of Magnetic Resonance Open
NMR
Hyperpolarization
DNP, dDNP
1H spin polarization
Lineshape polarimetry
13C-Sodium formate
title 13C-Formate as an indirect low-temperature 1H lineshape polarimeter
title_full 13C-Formate as an indirect low-temperature 1H lineshape polarimeter
title_fullStr 13C-Formate as an indirect low-temperature 1H lineshape polarimeter
title_full_unstemmed 13C-Formate as an indirect low-temperature 1H lineshape polarimeter
title_short 13C-Formate as an indirect low-temperature 1H lineshape polarimeter
title_sort 13c formate as an indirect low temperature 1h lineshape polarimeter
topic NMR
Hyperpolarization
DNP, dDNP
1H spin polarization
Lineshape polarimetry
13C-Sodium formate
url http://www.sciencedirect.com/science/article/pii/S2666441024000177
work_keys_str_mv AT stuartjelliott 13cformateasanindirectlowtemperature1hlineshapepolarimeter
AT quentinstern 13cformateasanindirectlowtemperature1hlineshapepolarimeter
AT samijannin 13cformateasanindirectlowtemperature1hlineshapepolarimeter