超处女橄油的核磁共振分析:通过secoiridoids进行分类
Constantinos G Tsiafoulis1,2, Christina Liaggou3, Achilleas Garoufis4
1NMR Centre, Laboratory of Analytical Chemistry, Department of Chemistry, University of Ioannina, Ioannina, Greece.
Journal of the science of food and agriculture
|November 29, 2023
概括
额外处女橄油 (EVOO) 样本使用基于基含量的新1H-NMR方法进行分类. 确定了一种新的化合物,可能表明EVOO的质量和药理价值.
科学领域:
- 分析化学 分析化学
- 食品化学 食品化学
- 频谱学是一种光谱学.
背景情况:
- 超处女橄油 (EVOO) 分析对于理解其特性至关重要.
- 核磁共振 (NMR) 光谱为化学分析提供了优势,没有分离.
- -omics方法可以提供新的见解和帮助样本分类.
研究的目的:
- 根据化物含量对EVOO样本进行分类,使用一种新的1H-NMR量化方法.
- 为了研究高化物含量对NMR光谱的影响.
- 为了确定EVOO分类的潜在新指标.
主要方法:
- 对12个EVOO样本进行单变量和多变量分析.
- 用于化学成分监测的H-NMR光谱.
- 基于secoiridoid和衍生品含量进行样本分类的代谢方法.
主要成果:
- EVOO样本被分为高化物 (OEH) 和非高化物 (OE) 类别.
- 特殊的化合物,如油脂素,油甘和乙烯酸,强烈区分了这些类别.
- 在OEH样本中发现了一种新的同位素化合物,该化合物首次被检测到,可以作为分类指标.
结论:
- 一种未经引用的量化方法成功地根据化物含量对EVOO样本进行了分类.
- 过高的化物含量显著影响H-NMR频谱的特定区域.
- 新发现的化合物可以作为EVOO分类的有价值指标,可能与增强的营养和药理价值有关.
相关概念视频
Chromatographic Methods: Classification
2.3K
Chromatographic techniques are classified in three ways: the classification is based on the physical state of the stationary and mobile phases, how the mobile phase and the stationary phase contact each other, or through the chemical or physical processes that isolate the components of the sample. Typically, the mobile phase is either a liquid or gas, while the stationary phase is either a solid or a liquid layer applied to a solid surface.
Chromatographic techniques are typically named by...
Chromatographic techniques are typically named by...
2.3K
IR and UV–Vis Spectroscopy of Carboxylic Acids
4.2K
In IR spectroscopy of carboxylic acids, the C=O bond shows a characteristic band between 1710 and 1760 cm⁻¹, and the O–H bond exhibits a broad band between 2500 and 3300 cm⁻¹.
However, the stretching absorptions for the C=O bond vary depending on the structure of carboxylic acids. The C=O bond of the free carboxylic acids shows a higher stretching frequency, 1760 cm−1, while H-bonded carboxylic acids (dimers) exhibit stretching absorptions at a lower frequency,...
However, the stretching absorptions for the C=O bond vary depending on the structure of carboxylic acids. The C=O bond of the free carboxylic acids shows a higher stretching frequency, 1760 cm−1, while H-bonded carboxylic acids (dimers) exhibit stretching absorptions at a lower frequency,...
4.2K
NMR Spectroscopy of Aromatic Compounds
4.7K
Aromatic compounds can be identified or analyzed using proton NMR and carbon‐13 NMR. Typically, aromatic hydrogens or hydrogens directly bonded to the aromatic rings are strongly deshielded by the aromatic ring current. Therefore, they absorb in the range of 6.5–8.0 ppm in proton NMR spectra. For instance, aromatic hydrogens directly bonded to the benzene ring absorb at 7.3 ppm. However, aromatic hydrogens of larger rings absorb farther upfield or downfield than the ideal range.
4.7K
Spectroscopy of Carboxylic Acid Derivatives
2.3K
Infrared spectroscopy is primarily used to determine the types of bonds and functional groups. In carboxylic acid derivatives, a typical carbonyl bond absorption is observed around 1650–1850 cm−1. For esters, the absorption is recorded at around 1740 cm−1, while acid halides show the absorption at about 1800 cm−1. Another acid derivative, the acid anhydrides, exhibit two carbonyl absorption around 1760 cm−1 and 1820 cm−1, arising from the symmetrical and...
2.3K
IR Spectroscopy: Molecular Vibration Overview
2.3K
When Infrared (IR) radiation passes through a covalently bonded molecule, the bonds transition from lower to higher vibrational levels. The fundamental vibrational motions that result in infrared absorption can be classified as stretching or bending vibrations.
Stretching vibrations are vibrational motions that occur along the bond line, changing the bond length or distance between two bonded atoms. They are further distinguished as symmetric or asymmetric. In symmetric stretching, the...
Stretching vibrations are vibrational motions that occur along the bond line, changing the bond length or distance between two bonded atoms. They are further distinguished as symmetric or asymmetric. In symmetric stretching, the...
2.3K
NMR and Mass Spectroscopy of Carboxylic Acids
4.0K
In ¹H NMR spectroscopy, acidic protons (–COOH) of carboxylic acids are highly deshielded and absorb far downfield, at around 9–12 ppm. The chemical shift value depends on the concentration and solvent used.
While α protons of carboxylic acids absorb at 2–2.5 ppm, β protons absorb further upfield.
Carboxylic acids are easily identified by dissolving them in deuterium oxide, which results in a rapid exchange of the acidic protons with deuterium. This leads to the...
While α protons of carboxylic acids absorb at 2–2.5 ppm, β protons absorb further upfield.
Carboxylic acids are easily identified by dissolving them in deuterium oxide, which results in a rapid exchange of the acidic protons with deuterium. This leads to the...
4.0K


