Comparison of various sampling schemes and accumulation profiles in covariance spectroscopy with exponentially decaying 2D signals
Literature Information
Bingwen Hu, Qun Chen, Qiang Wang, Zhengfeng Zhang, Jun Yang, Isao Noda, Julien Trébosc, Oliver Lafon, Jean-Paul Amoureux, Feng Deng
Two-dimensional covariance (COV2D) spectroscopy offers an alternative approach to 2D Fourier transformation (FT2D) to obtain homo-nuclear correlation NMR spectra. Considerable saving in experimental time, without loss of resolution, can be achieved by incorporating COV2D with: (i) uniform sampling with a t1 cut-off (CUO) or non-uniform sampling (NUS), and (ii) constant or Gaussian accumulation profiles. We find that covariance treatment, combined with the CUO sampling and Gaussian accumulation profile provides better gain in experimental time, with respect to that required with FT2D NMR. This is in contrast with the maximum entropy (MaxEnt) reconstruction for 2D spectra, which works better with the NUS scheme rather than with the CUO scheme. We further discuss the experimental conditions that define this optimum acquisition, and explain how these parameters can easily be optimized ‘on the fly’ according to the desired resolution, which is quite sample-dependent.
Recommended Journals
Related Literature
Tuning of electron transfer reactions in pluronic–surfactant supramolecular assemblies
Poonam Verma, Haridas Pal
DOI: 10.1039/C5CP01480H
Structural differences between the active sites of the Ni-A and Ni-B states of the [NiFe] hydrogenase: an approach by quantum chemistry and single crystal ENDOR spectroscopy
Jessica L. Barilone, Hideaki Ogata, Wolfgang Lubitz, Maurice van Gastel
DOI: 10.1039/C5CP01322D
Co-electrodeposition of RuO2–MnO2 nanowires and the contribution of RuO2 to the capacitance increase
Zhe Gui, Eleanor Gillette, Jonathon Duay, Junkai Hu, Nam Kim, Sang Bok Lee
DOI: 10.1039/C5CP01814E
Singlet ground state actinide chemistry with geminals
Paweł Tecmer, Katharina Boguslawski, Paul W. Ayers
DOI: 10.1039/C4CP05293E
Gated electron transfer reactions of truncated hemoglobin from Bacillus subtilis differently orientated on SAM-modified electrodes
Deby Fapyane, Andrey Kartashov, Claes von Wachenfeldt, Elena E. Ferapontova
DOI: 10.1039/C5CP00960J
Electronic couplings for molecular charge transfer: benchmarking CDFT, FODFT and FODFTB against high-level ab initio calculations. II
Adam Kubas, Fruzsina Gajdos, Harald Oberhofer, Jochen Blumberger
DOI: 10.1039/C4CP04749D
Peculiar morphological transitions induced by nanoparticles in polymeric blends: retarded relaxation or altered interfacial tension?
Shital Patangrao Pawar, Suryasarathi Bose
DOI: 10.1039/C5CP01644D
Wetting of water on hexagonal boron nitride@Rh(111): a QM/MM model based on atomic charges derived for nano-structured substrates
Dorothea Golze, Jürg Hutter, Marcella Iannuzzi
DOI: 10.1039/C4CP04638B
Hybrid QTAIM and electrostatic potential-based quantum topology phase diagrams for water clusters
Anmol Kumar, Shridhar R. Gadre, Xiao Chenxia, Xu Tianlv, Steven Robert Kirk, Samantha Jenkins
DOI: 10.1039/C5CP01039J
You might also like
What are the main uses of (5-Sulfamoyl-3-pyridinyl)boronic acid (CAS: 951233-61-7)?
(5-Sulfamoyl-3-pyridinyl)boronic acid is primarily used in chemical synthesis, p...
How is Benzyl 2-methyl-2-(methylsulfonyl)-4-pentenoate (CAS: 1942858-50-5) typically synthesized?
Benzyl 2-methyl-2-(methylsulfonyl)-4-pentenoate is typically synthesized via est...
What precautions should be taken when handling 8-Fluoroquinolin-6-ol (CAS: 209353-22-0)?
When handling 8-Fluoroquinolin-6-ol (CAS: 209353-22-0), it is important to use p...
What are the physical and chemical properties of 1,3-Dibromo-5-(2-methyl-2-propanyl)benzene (CAS: 129316-09-2)?
1,3-Dibromo-5-(2-methyl-2-propanyl)benzene (CAS: 129316-09-2) is a crystalline c...
What industries use Ethyl 7-chloro-4-oxo-1-(1,3-thiazol-2-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylate (CAS: 174726-87-5)?
Ethyl 7-chloro-4-oxo-1-(1,3-thiazol-2-yl)-1,4-dihydro-1,8-naphthyridine-3-carbox...
What precautions should be taken when handling Delta-7-Avenasterol (CAS: 23290-26-8)?
When handling Delta-7-Avenasterol (CAS: 23290-26-8), it is important to wear app...
What precautions should be taken when handling N-({(5R)-3-[3-Fluoro-4-(4-morpholinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl}methyl)acetamide (CAS: 872992-20-6)?
Proper handling involves the use of personal protective equipment such as gloves...
What precautions should be taken when handling 2-Methyl-2-proanyl 4-[(2-aminophenyl)amino]-1-piperidinecarboxylate (CAS: 79099-00-6)?
When handling 2-Methyl-2-proanyl 4-[(2-aminophenyl)amino]-1-piperidinecarboxylat...
What is N-Methyl-4-chlorobenzylamine hydrochloride (CAS: 65542-24-7)?
N-Methyl-4-chlorobenzylamine hydrochloride (CAS: 65542-24-7) is a organic compou...
Is [2-(Dodecyloxy)ethoxy]acetic acid (CAS: 27306-90-7) safe?
[2-(Dodecyloxy)ethoxy]acetic acid (CAS: 27306-90-7) is generally considered safe...
Source Journal
Analyst

Analyst publishes analytical and bioanalytical research that reports premier fundamental discoveries and inventions, and the applications of those discoveries, unconfined by traditional discipline barriers.










![5-Chloropyrrolo[2,1-f][1,2,4]triazin-4(3H)-one structure 5-Chloropyrrolo[2,1-f][1,2,4]triazin-4(3H)-one structure](https://static.chemtradehub.com/structs/888/888720-60-3-4f7c.webp)


![4-Fluoro-2-(4-{[(3S,4R)-4-(2-hydroxy-2-propanyl)-3-pyrrolidinyl]amino}-6,7-dimethoxy-2-quinazolinyl)phenol hydrochloride (1:1) structure 4-Fluoro-2-(4-{[(3S,4R)-4-(2-hydroxy-2-propanyl)-3-pyrrolidinyl]amino}-6,7-dimethoxy-2-quinazolinyl)phenol hydrochloride (1:1) structure](https://static.chemtradehub.com/structs/143/1431697-96-9-619c.webp)
