17O NMR spectroscopy protocol for the determination of water content in liquids produced by pyrolysis and hydrothermal liquefaction DOI Creative Commons
Noora Jokinen,

Eemeli Eronen,

Jouko Vepsäläinen

et al.

Analytica Chimica Acta, Journal Year: 2024, Volume and Issue: 1329, P. 343188 - 343188

Published: Aug. 30, 2024

There is an urgent need to replace fossil-based fuels and chemicals with bio-based, renewable alternatives. Water content a critical parameter in these liquid products since water affects their quality properties. However, currently existing methods for bio-oil determination have limitations thus, there find that are versatile, work wide sample consistency range repeatably reliably safe the user environment.

Language: Английский

Rapid Detection of Adulteration in Boswellia Extracts with Citric Acid by UPLC–HRMS and 1 H NMR DOI
Péter Püski, Tímea Körmöczi, Róbert Berkecz

et al.

Journal of Dietary Supplements, Journal Year: 2024, Volume and Issue: 21(4), P. 462 - 477

Published: Jan. 2, 2024

ole-gum-resin extracts (BSEs) are commonly used as food supplements, especially in osteoarthritis management. The quality standard is established by determining 11-keto-β-boswellic acid (KBA) and acetyl-11-keto-boswellic (AKBA) content using high-performance liquid chromatography (HPLC) or assessing the total boswellic (TBA) titrimetry. limited geographical distribution of

Language: Английский

Citations

3

Efficient Quantification of Milk Metabolites from 1H NMR Spectra Using the Signature Mapping (SigMa) Approach: Chemical Shift Library Development for Cows’ Milk and Colostrum DOI
Paraskevi Tsermoula, N.B. Kristensen, Nabiollah Mobaraki

et al.

Analytical Chemistry, Journal Year: 2024, Volume and Issue: 96(5), P. 1861 - 1871

Published: Jan. 26, 2024

Cow milk contains essential nutrients for humans, and its bulk composition is usually analyzed using Fourier transform infrared spectroscopy. The higher sensitivity of nuclear magnetic resonance (NMR) spectroscopy can augment the extractible qualitative quantitative information from to nearly 60 compounds, enabling us monitor health cows quality. Proton (

Language: Английский

Citations

2

Exploring the Intersection of Geophysics and Diagnostic Imaging in the Health Sciences DOI Creative Commons
Rahul Kumar Singh,

Nirlipta Priyadarshini Nayak,

Tapan Behl

et al.

Diagnostics, Journal Year: 2024, Volume and Issue: 14(2), P. 139 - 139

Published: Jan. 8, 2024

To develop diagnostic imaging approaches, this paper emphasizes the transformational potential of merging geophysics with health sciences. Diagnostic technology improvements have transformed sciences by enabling earlier and more precise disease identification, individualized therapy, improved patient care. This review article examines connection between in field Geophysics, which is typically used to explore Earth’s subsurface, has provided new uses its methodology medical field, providing innovative solutions pressing problems. The different geophysical techniques like electrical imaging, seismic their corresponding tomography, magnetic resonance ultrasound etc. examination includes description, similarities, differences, challenges associated these how modified can be methods Examining progression each method from contributions illness diagnosis, treatment planning, monitoring are highlighted. Also, utilization data analysis signal processing inversion image been briefly explained, along mathematical computational tools they implemented for key findings include development machine learning artificial intelligence geophysics-driven demonstrating revolutionary effects data-driven on precision, speed, predictive modeling.

Language: Английский

Citations

2

LAMAIS: A Library-Aided Approach for Efficient 1D 1H NMR Qualitative Analysis in Plant Metabolomics DOI

Xinyuan Xie,

Jiayu Yang, Yuting Lu

et al.

Analytica Chimica Acta, Journal Year: 2024, Volume and Issue: 1326, P. 343100 - 343100

Published: Aug. 14, 2024

Citations

2

Optimization of heteronuclear ultrafast 2D NMR for the study of complex mixtures hyperpolarized by dynamic nuclear polarization DOI
Clément Praud,

Victor Ribay,

Arnab Dey

et al.

Analytical Methods, Journal Year: 2023, Volume and Issue: 15(45), P. 6209 - 6219

Published: Jan. 1, 2023

Ultrafast 2D NMR spectroscopy combined with dissolution dynamic nuclear polarization provides rich, sensitive and repeatable fingerprints of complex mixtures.

Language: Английский

Citations

4

1H Nuclear Magnetic Resonance, Infrared, and Chemometrics in Lipid Analysis of Brazilian Edible-Oil-Based Nutraceuticals DOI Open Access
Igor Savioli Flores, Daniel Luiz Rodrigues da Annunciação, Vinícius S. Pinto

et al.

Deleted Journal, Journal Year: 2024, Volume and Issue: 1(1), P. 18 - 29

Published: April 2, 2024

Edible oils have commercial and nutritional value due to the presence of essential fatty acids. They can be consumed fresh in form capsules known as nutraceuticals. The quality such products is interest consumer. In this context, study describes a method based on high-resolution nuclear magnetic resonance (NMR) Fourier-transform mid-infrared spectroscopic analysis (FTIR), combined with statistical analyses, differentiate different edible used nutraceuticals Brazil by acid content. Through 1H NMR spectra, levels saturated unsaturated acids were characterized quantified. Statistical data confirmed real distinctions between nutraceutical raw materials, emphasis ω-9, ω-6, ω-3 analytical approach presented also demonstrates potential identify origin (animal or vegetable)

Language: Английский

Citations

1

Quantitative composition analysis of natural gas by high-pressure proton low-field NMR spectroscopy: Development of an improved experimental methodology DOI Creative Commons
Sergio Alejandro Ortiz Restrepo,

A. Swiatek,

Andreas Ohligschläger

et al.

Gas Science and Engineering, Journal Year: 2024, Volume and Issue: 128, P. 205377 - 205377

Published: June 15, 2024

Natural gas (NG) has been proposed as a bridging fuel between fossil and renewable energy sources, playing significant role in the decarbonization of sector. Its commercial value integrity NG infrastructure depend on physical properties, which are strongly related to its composition. Thus, development low-cost reliable analytical methods for composition analysis can enable more efficient operation. Recently, we showed that high-pressure (HP) benchtop 1H NMR spectroscopy combined with indirect hard modelling (IHM) is an method quantification NG. The current work extends this methodology by introducing testing novel experimental strategies increasing reliability accuracy method. This new approach includes use recently published tube design single-scan acquisition quality control parameters obtain highly reproducible peak shape spectra over long periods. tested binary, ternary, complex mixtures at 200 bar 160 gives compositions excellent agreement vendor certificates.

Language: Английский

Citations

1

Quantitative Blood Serum IVDr NMR Spectroscopy in Clinical Metabolomics of Cancer, Neurodegeneration, and Internal Medicine DOI
Christoph Trautwein

Methods in molecular biology, Journal Year: 2024, Volume and Issue: unknown, P. 427 - 443

Published: Oct. 1, 2024

Language: Английский

Citations

1

1H NMR Mixture Design–Fingerprints and ASCA Analysis in Ilex paraguariensis: Model Stability in Search of a Global Metabolome DOI
Gustavo Galo Marcheafave, Elis Daiane Pauli, Cláudia Domiciano Tormena

et al.

Analytical Chemistry, Journal Year: 2023, Volume and Issue: 95(46), P. 16850 - 16860

Published: Nov. 10, 2023

The effects of experimental repetitions and solvent extractors on the 1H NMR fingerprinting yerba mate extracts, obtained from two genders light environments, were analyzed in-depth by ANOVA–simultaneous component analysis (ASCA). Different solvents used according to a mixture design based ethanol, dichloromethane, hexane their combinations. number significantly affected ASCA results. Increasing led decreases in percentage effect variance values an increase residual variance. However, secondary sexual dimorphism, availability, interaction became more significant with decreasing p-values at or above 95% confidence level. choice extractor affects chemical profile can lead distinct conclusions regarding significance values. Pure yielded different about factorial effects, each extracting unique metabolites maximizing information for specific effects. use binary mixtures, such as ethanol–dichloromethane, proved efficient sets compounds that simultaneously differentiate between conditions. design–fingerprint strategy provided satisfactory results expanding range extracted high variances low explained models. Ternary even higher-ordered mixtures could be good alternative media work-intensive procedures. Our study underscores selection metabolomic analysis, improving accuracy, robustness, interpretability models, leading better understanding composition biological implications plant extracts.

Language: Английский

Citations

2

Synthesis of Metabolites and Metabolite-like Compounds Using Biocatalytic Systems DOI Creative Commons
Roland Wohlgemuth

Metabolites, Journal Year: 2023, Volume and Issue: 13(10), P. 1097 - 1097

Published: Oct. 19, 2023

Methodologies for the synthesis and purification of metabolites, which have been developed following their discovery, analysis, structural identification, involved in numerous life science milestones. The renewed focus on small molecule domain biological cells has also created an increasing awareness rising gap between metabolites identified prepared as pure compounds. design engineering resource-efficient straightforward synthetic methodologies production diverse metabolite-like compounds attracted much interest. variety metabolic pathways provides a wonderful blueprint designing simplified routes to desired metabolites. Therefore, biocatalytic systems become key enabling tools number can then be utilized standards, enzyme substrates, inhibitors, or other products, discovery novel functions.

Language: Английский

Citations

1