scholarly journals STUDY OF COMPOSITION OF HIGH-VISCOUS HEAVY OILS BY METHOD OF NUCLEAR MAGNETIC RESONANT SPECTROSCOPY

Author(s):  
Olga Yu. Poletaeva ◽  
Alexandr Yu. Leontev ◽  
Eldar M. Movsumzade ◽  
Galina Yu. Kolchina ◽  
Elbay R. Babayev

The work uses the nuclear magnetic resonance method to study the composition of heavy high-viscosity oils of various fields of the Volga Ural oil and gas basin. The spectra were recorded on a Bruker Avance III 500MHz high resolution NMR spectrometer with operating frequencies of 1H (500.1 MHz) and 13C (125.8 MHz) at a constant sample temperature in CDCl3. It is established that the oil of the studied field in its physical and chemical characteristics, structural group composition of resins, asphaltenes and oil components is a typical representative of aromatic oils. Oil samples are characterized by high density, a high content of tar-asphaltene compounds and sulfur. In the 1H NMR scale, methylene and methine signals appear in the range from 1.0 to 2.3 ppm: β-CH2, some β-CH groups in aromatic compounds and β-CH, CH2-groups in hydroaromatic compounds, and in the 13C NMR scale they are in the range from 22 to 60 ppm: methylene group (CH2-) in naphthenic fragments, etc. An analysis of the aromaticity coefficients obtained from the 1H and 13C NMR spectra shows a high convergence of the results and indicates a high degree of aromatic condensation in oil samples with a density of 950 kg/m3, a viscosity of 7200 mPa*s at 20 °C and a density of 948 kg/m3, viscosity 1000 mPa·s (FHA=0.046-0.081). With an increase in viscosity, there is a clear tendency to increase the aromaticity coefficient and the average chain length. It follows from the results of the 1H NMR spectra of oils with different origins, viscosities and processing that crude and refined oils may differ in water and olefin signals, and from 13C NMR analysis for oils the most important results were obtained when assessing the concentration of primary, tertiary and aromatic carbon.

2020 ◽  
Vol 24 (10) ◽  
pp. 1139-1147
Author(s):  
Yang Mingyan ◽  
Wang Daoquan ◽  
Wang Mingan

2-Phenylcyclododecanone and 2-cyclohexylcyclododecanone derivatives were synthesized and characterized by 1H NMR, 13C NMR, HR-ESI-MS and X-ray diffraction. Their preferred conformations were analyzed by the coupling constants in the 1H NMR spectra and X-ray diffraction, which showed the skeleton ring of these derivatives containing [3333]-2-one conformation, and the phenyl groups were located at the side-exo position of [3333]-2-one conformation due to the strong π-π repulsive interaction between the π- electron of benzene ring and π-electron of carbonyl group. The cyclohexyl groups were located at the corner-syn or the side-exo position of [3333]-2-one conformation depending on the hindrance of the other substituted groups. The π-π electron effect played a crucial role in efficiently controlling the preferred conformation of 2-aromatic cyclododecanone and the other 2-aromatic macrocyclic derivatives with the similar preferred square and rectangular conformations.


2009 ◽  
Vol 51 (2) ◽  
pp. 205-212 ◽  
Author(s):  
Peter de Peinder ◽  
Tom Visser ◽  
Derek D. Petrauskas ◽  
Fabien Salvatori ◽  
Fouad Soulimani ◽  
...  

2012 ◽  
Vol 518-523 ◽  
pp. 3989-3992 ◽  
Author(s):  
Yang Zhang ◽  
Xiao Hua Tu ◽  
Cheng Ping Miao ◽  
Jian Yi Wu

A novel CIL of N-butyl-N-methyl imidazolium-D-(-)-tartrate has been designed and synthesized by neutralization reaction. Its structure was characterized by 1H-NMR and 13C-NMR spectra, the optical rotation was characterized by polarimeter with the value of-15.0º, and the purity was characterized by ion chromatography with the value of 98.4%.


2020 ◽  
Vol 100 (4) ◽  
pp. 60-74
Author(s):  
А.А. Bakibaev ◽  
◽  
М.Zh. Sadvakassova ◽  
V.S. Malkov ◽  
R.Sh. Еrkasov ◽  
...  

A wide variety of acyclic ureas comprising alkyl, arylalkyl, acyl, and aryl functional groups are investigated by nuclear magnetic resonance spectroscopy. In general, spectral characteristics of more than 130 substances based on acyclic ureas dissolved in deuterated dimethyl sulfoxide at room temperature are studied. The re-sults obtained based on the studies of 1H and 13C NMR spectra of urea and its N-alkyl-, N-arylalkyl-, N-aryl- and 1,3-diaryl derivatives are presented, and the effect of these functional groups on the chemical shifts in carbonyl and amide moieties in acyclic urea derivatives is discussed. An introduction of any type of substitu-ent (electron-withdrawing or electron-donating) into urea molecule is stated to result in a strong upfield shift in 13C NMR spectra relatively to unsubstituted urea. A strong sensitivity of NH protons to the presence of acyl and aryl groups in nuclear magnetic resonance spectra is pointed out. In some cases, qualitative depend-encies between the chemical shifts in the NMR spectra and the structure of the studied acyclic ureas are re-vealed. A summary of the results on chemical shifts in the NMR spectra of the investigated substances allows determining the ranges of chemical shift variations of the key protons and carbon atoms in acyclic ureas. The literature describing the synthesis procedures are provided. The results obtained significantly expand the methods of reliable identification of biologically active acyclic ureas and their metabolites that makes it promising to use NMR spectroscopy both in biochemistry and in clinical practice.


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