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Structure Characterization and Solubility Analysis of the Existent Gum of the Fischer–Tropsch Synthetic Crude

[Image: see text] The existent gum content of the Fisher–Tropsch synthetic crude exceeded the standard seriously, affecting its transportation and use. To determine the structure of the existent gum extracted from the Fisher–Tropsch synthetic crude, elemental analysis, Fourier transform infrared (FT...

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Autores principales: Liu, Jie, Tian, Feng, Liu, Jieping, Guo, Qing, Fan, Xiaoyong, Dan, Yong, Fu, Quanjun, Du, Zonggang, Han, Wei, Song, Di, Li, Dong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2020
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7408234/
https://www.ncbi.nlm.nih.gov/pubmed/32775879
http://dx.doi.org/10.1021/acsomega.0c01871
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author Liu, Jie
Tian, Feng
Liu, Jieping
Guo, Qing
Fan, Xiaoyong
Dan, Yong
Fu, Quanjun
Du, Zonggang
Han, Wei
Song, Di
Li, Dong
author_facet Liu, Jie
Tian, Feng
Liu, Jieping
Guo, Qing
Fan, Xiaoyong
Dan, Yong
Fu, Quanjun
Du, Zonggang
Han, Wei
Song, Di
Li, Dong
author_sort Liu, Jie
collection PubMed
description [Image: see text] The existent gum content of the Fisher–Tropsch synthetic crude exceeded the standard seriously, affecting its transportation and use. To determine the structure of the existent gum extracted from the Fisher–Tropsch synthetic crude, elemental analysis, Fourier transform infrared (FT-IR) spectroscopy, nuclear magnetic resonance (NMR), and X-ray photoelectron spectroscopy (XPS) were employed to determine the chemical structure of the gum. The Brown–Ladner method is used to calculate the average structural parameters and the average molecular formula of the existent gum. The results show that the existent gum of the Fisher–Tropsch synthetic crude is composed of heterocyclic aromatic hydrocarbons and short-carbon paraffins. Compared with petroleum gums and coal tar gums, the existent gum content of the Fisher–Tropsch synthetic crude has the characteristics of high aromaticity, short side chains, and nitrogen-containing heterocycles. After being oxidized, its aromaticity further increases, more closed loops are formed, and the side chain is further shortened. This is caused by a complex oxidation reaction during the oxidation process. Molecular dynamics simulation calculations were performed to reveal the T-stacked morphology of the existent gum of the Fisher–Tropsch synthetic crude in a mixed solvent of acetone and toluene.
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spelling pubmed-74082342020-08-07 Structure Characterization and Solubility Analysis of the Existent Gum of the Fischer–Tropsch Synthetic Crude Liu, Jie Tian, Feng Liu, Jieping Guo, Qing Fan, Xiaoyong Dan, Yong Fu, Quanjun Du, Zonggang Han, Wei Song, Di Li, Dong ACS Omega [Image: see text] The existent gum content of the Fisher–Tropsch synthetic crude exceeded the standard seriously, affecting its transportation and use. To determine the structure of the existent gum extracted from the Fisher–Tropsch synthetic crude, elemental analysis, Fourier transform infrared (FT-IR) spectroscopy, nuclear magnetic resonance (NMR), and X-ray photoelectron spectroscopy (XPS) were employed to determine the chemical structure of the gum. The Brown–Ladner method is used to calculate the average structural parameters and the average molecular formula of the existent gum. The results show that the existent gum of the Fisher–Tropsch synthetic crude is composed of heterocyclic aromatic hydrocarbons and short-carbon paraffins. Compared with petroleum gums and coal tar gums, the existent gum content of the Fisher–Tropsch synthetic crude has the characteristics of high aromaticity, short side chains, and nitrogen-containing heterocycles. After being oxidized, its aromaticity further increases, more closed loops are formed, and the side chain is further shortened. This is caused by a complex oxidation reaction during the oxidation process. Molecular dynamics simulation calculations were performed to reveal the T-stacked morphology of the existent gum of the Fisher–Tropsch synthetic crude in a mixed solvent of acetone and toluene. American Chemical Society 2020-07-24 /pmc/articles/PMC7408234/ /pubmed/32775879 http://dx.doi.org/10.1021/acsomega.0c01871 Text en Copyright © 2020 American Chemical Society This is an open access article published under an ACS AuthorChoice License (http://pubs.acs.org/page/policy/authorchoice_termsofuse.html) , which permits copying and redistribution of the article or any adaptations for non-commercial purposes.
spellingShingle Liu, Jie
Tian, Feng
Liu, Jieping
Guo, Qing
Fan, Xiaoyong
Dan, Yong
Fu, Quanjun
Du, Zonggang
Han, Wei
Song, Di
Li, Dong
Structure Characterization and Solubility Analysis of the Existent Gum of the Fischer–Tropsch Synthetic Crude
title Structure Characterization and Solubility Analysis of the Existent Gum of the Fischer–Tropsch Synthetic Crude
title_full Structure Characterization and Solubility Analysis of the Existent Gum of the Fischer–Tropsch Synthetic Crude
title_fullStr Structure Characterization and Solubility Analysis of the Existent Gum of the Fischer–Tropsch Synthetic Crude
title_full_unstemmed Structure Characterization and Solubility Analysis of the Existent Gum of the Fischer–Tropsch Synthetic Crude
title_short Structure Characterization and Solubility Analysis of the Existent Gum of the Fischer–Tropsch Synthetic Crude
title_sort structure characterization and solubility analysis of the existent gum of the fischer–tropsch synthetic crude
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7408234/
https://www.ncbi.nlm.nih.gov/pubmed/32775879
http://dx.doi.org/10.1021/acsomega.0c01871
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