Statistical Reaction Analysis of Residue Desulfurization Based on Molecular Structures

Heavy oils contain many kinds of organic compounds which have complex structures. Thus, it is difficult to determine these characteristics to develop suitable catalysts. Recently, due to the development of Fourier transform ion cyclotron resonance mass spectrometry (FT-ICR-MS), the detailed composit...

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Autores principales: Yasuki Kansha, Shoma Kato, Koji Tsuji
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Lenguaje:EN
Publicado: AIDIC Servizi S.r.l. 2021
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Acceso en línea:https://doaj.org/article/aa6328431c0f4ddbaebf2b16fe7b76e5
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spelling oai:doaj.org-article:aa6328431c0f4ddbaebf2b16fe7b76e52021-11-15T21:48:31ZStatistical Reaction Analysis of Residue Desulfurization Based on Molecular Structures10.3303/CET21880612283-9216https://doaj.org/article/aa6328431c0f4ddbaebf2b16fe7b76e52021-11-01T00:00:00Zhttps://www.cetjournal.it/index.php/cet/article/view/11854https://doaj.org/toc/2283-9216Heavy oils contain many kinds of organic compounds which have complex structures. Thus, it is difficult to determine these characteristics to develop suitable catalysts. Recently, due to the development of Fourier transform ion cyclotron resonance mass spectrometry (FT-ICR-MS), the detailed composition data of heavy oils can be obtained. In this research, the authors proposed a new method to analyse chemical reactions using the input/output composition data from FT-ICR-MS. In this method, representative chemical reactions were defined and assumed the series of reactions linearly. As a result, the conversion ratios of each chemical reaction can be simply obtained and statistically compared by molecular structures. The authors applied this method to a residue desulfurization in a petroleum refinery as a case study and compared the reaction ratios by molecular structures. From this analysis, the authors found that the molecular structure significantly affects the conversion ratio in desulfurization reaction and captured the characteristics of this reaction. Therefore, this analysis might be promising to analyse reactions for providing insights into catalysts and process design.Yasuki KanshaShoma KatoKoji TsujiAIDIC Servizi S.r.l.articleChemical engineeringTP155-156Computer engineering. Computer hardwareTK7885-7895ENChemical Engineering Transactions, Vol 88 (2021)
institution DOAJ
collection DOAJ
language EN
topic Chemical engineering
TP155-156
Computer engineering. Computer hardware
TK7885-7895
spellingShingle Chemical engineering
TP155-156
Computer engineering. Computer hardware
TK7885-7895
Yasuki Kansha
Shoma Kato
Koji Tsuji
Statistical Reaction Analysis of Residue Desulfurization Based on Molecular Structures
description Heavy oils contain many kinds of organic compounds which have complex structures. Thus, it is difficult to determine these characteristics to develop suitable catalysts. Recently, due to the development of Fourier transform ion cyclotron resonance mass spectrometry (FT-ICR-MS), the detailed composition data of heavy oils can be obtained. In this research, the authors proposed a new method to analyse chemical reactions using the input/output composition data from FT-ICR-MS. In this method, representative chemical reactions were defined and assumed the series of reactions linearly. As a result, the conversion ratios of each chemical reaction can be simply obtained and statistically compared by molecular structures. The authors applied this method to a residue desulfurization in a petroleum refinery as a case study and compared the reaction ratios by molecular structures. From this analysis, the authors found that the molecular structure significantly affects the conversion ratio in desulfurization reaction and captured the characteristics of this reaction. Therefore, this analysis might be promising to analyse reactions for providing insights into catalysts and process design.
format article
author Yasuki Kansha
Shoma Kato
Koji Tsuji
author_facet Yasuki Kansha
Shoma Kato
Koji Tsuji
author_sort Yasuki Kansha
title Statistical Reaction Analysis of Residue Desulfurization Based on Molecular Structures
title_short Statistical Reaction Analysis of Residue Desulfurization Based on Molecular Structures
title_full Statistical Reaction Analysis of Residue Desulfurization Based on Molecular Structures
title_fullStr Statistical Reaction Analysis of Residue Desulfurization Based on Molecular Structures
title_full_unstemmed Statistical Reaction Analysis of Residue Desulfurization Based on Molecular Structures
title_sort statistical reaction analysis of residue desulfurization based on molecular structures
publisher AIDIC Servizi S.r.l.
publishDate 2021
url https://doaj.org/article/aa6328431c0f4ddbaebf2b16fe7b76e5
work_keys_str_mv AT yasukikansha statisticalreactionanalysisofresiduedesulfurizationbasedonmolecularstructures
AT shomakato statisticalreactionanalysisofresiduedesulfurizationbasedonmolecularstructures
AT kojitsuji statisticalreactionanalysisofresiduedesulfurizationbasedonmolecularstructures
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