Chemical-structural characterization of solvent and thermal extractable material from perhydrous vitrinites

In this work, the characterization of the non-covalently bonded compounds present in a set of perhydrous coals of different age and geographical location (Cretaceous coals: UCV and TCV and Jurassic coals: AJV, PGJV, WJVh and WJVl) was carried out by means of a combination of the analyses of the material soluble in chloroform and the thermal extract. The extract in chloroform was studied through GC/MS and NMR and the thermovaporized fraction was obtained by means of flash pyrolysis at the Curie temperature of 350°C and quantified by on-line GC-MS. The results obtained for the Cretaceous coals confirm that the substances responsible for the hydrogenation are those covalently bonded to the vitrinite network as a result of the modifications undergone by the botanical precursors. Despite the striking similarity in the global characteristics of these two coals (TCV and UCV) significant differences between the material non-covalently bonded to their coal matrices were found. These differences are attributed to the type of resins present in the coals and/or to their different degree of evolution. With respect to the Jurassic coals, the present study allows the process by which the hydrogenated substances were assimilated into their structure to be established. The characterization of the assimilated substances in the WJVl coal reveals an unexpectedly high incorporation of alkanes given the humic origin of this sample. From these results the assimilation of hydrogen-rich substances from the decomposition of the organic remains in the sedimentary environment in which WJVl precursor were deposited, is proposed. The incorporation of products derived from the primary decomposition of organic material is not evident for the WJVh and AJV coals. The substances assimilated into the coal matrices show a higher aromaticity, the aromatic structures of WJVh being more condensed than those found in AJV. The compositional differences between them probably arise from the different source of the hydrogen-rich material. In the case of AJV coal the source was the adsorption of hydrocarbons generated and migrated from the Pliensbachian source-rocks whereas in WJVh, assimilated compounds come from the material generated by the thermal transformation (coalification) of the adjacent organic rocks of similar age. Finally, PGJV shows two types of non-covalently bonded compounds. Solvent extractable material is mainly composed of the first type of compounds, which is predominantly aliphatic in nature with a preponderance of alkanes. The second type of compounds is more aromatic and they are probably located in the close porosity of this coal. They are not accessible to chloroform but they are the most abundant in the thermal extract.

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Main Authors: Iglesias, María José, Río Andrade, José Carlos del, Laggoun-Défarge, Fatima, Cuesta, María José, Suárez Ruiz, Isabel
Other Authors: European Commission
Format: artículo biblioteca
Language:English
Published: Elsevier 2003
Subjects:Perhydrous coal, Vitrinite, Soluble material, Thermal extract, Trapped compounds, NMR, Py–GC/MS (Curie temperature: 350°C),
Online Access:http://hdl.handle.net/10261/2607
http://dx.doi.org/10.13039/501100000780
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spelling dig-irnas-es-10261-26072018-11-16T08:08:22Z Chemical-structural characterization of solvent and thermal extractable material from perhydrous vitrinites Iglesias, María José Río Andrade, José Carlos del Laggoun-Défarge, Fatima Cuesta, María José Suárez Ruiz, Isabel European Commission Perhydrous coal Vitrinite Soluble material Thermal extract Trapped compounds NMR Py–GC/MS (Curie temperature: 350°C) In this work, the characterization of the non-covalently bonded compounds present in a set of perhydrous coals of different age and geographical location (Cretaceous coals: UCV and TCV and Jurassic coals: AJV, PGJV, WJVh and WJVl) was carried out by means of a combination of the analyses of the material soluble in chloroform and the thermal extract. The extract in chloroform was studied through GC/MS and NMR and the thermovaporized fraction was obtained by means of flash pyrolysis at the Curie temperature of 350°C and quantified by on-line GC-MS. The results obtained for the Cretaceous coals confirm that the substances responsible for the hydrogenation are those covalently bonded to the vitrinite network as a result of the modifications undergone by the botanical precursors. Despite the striking similarity in the global characteristics of these two coals (TCV and UCV) significant differences between the material non-covalently bonded to their coal matrices were found. These differences are attributed to the type of resins present in the coals and/or to their different degree of evolution. With respect to the Jurassic coals, the present study allows the process by which the hydrogenated substances were assimilated into their structure to be established. The characterization of the assimilated substances in the WJVl coal reveals an unexpectedly high incorporation of alkanes given the humic origin of this sample. From these results the assimilation of hydrogen-rich substances from the decomposition of the organic remains in the sedimentary environment in which WJVl precursor were deposited, is proposed. The incorporation of products derived from the primary decomposition of organic material is not evident for the WJVh and AJV coals. The substances assimilated into the coal matrices show a higher aromaticity, the aromatic structures of WJVh being more condensed than those found in AJV. The compositional differences between them probably arise from the different source of the hydrogen-rich material. In the case of AJV coal the source was the adsorption of hydrocarbons generated and migrated from the Pliensbachian source-rocks whereas in WJVh, assimilated compounds come from the material generated by the thermal transformation (coalification) of the adjacent organic rocks of similar age. Finally, PGJV shows two types of non-covalently bonded compounds. Solvent extractable material is mainly composed of the first type of compounds, which is predominantly aliphatic in nature with a preponderance of alkanes. The second type of compounds is more aromatic and they are probably located in the close porosity of this coal. They are not accessible to chloroform but they are the most abundant in the thermal extract. The financial support for this work was provided through a contract with the European Community (No. 7220/EC-769). Peer reviewed 2007-12-26T14:59:01Z 2007-12-26T14:59:01Z 2003 artículo http://purl.org/coar/resource_type/c_6501 Journal of Analytical and Applied Pyrolysis 68-69 (2003) 387-407 0165-2370 http://hdl.handle.net/10261/2607 10.1016/S0165-2370(03)00068-8 http://dx.doi.org/10.13039/501100000780 en open 292130 bytes application/pdf Elsevier
institution IRNAS ES
collection DSpace
country España
countrycode ES
component Bibliográfico
access En linea
databasecode dig-irnas-es
tag biblioteca
region Europa del Sur
libraryname Biblioteca del IRNAS España
language English
topic Perhydrous coal
Vitrinite
Soluble material
Thermal extract
Trapped compounds
NMR
Py–GC/MS (Curie temperature: 350°C)
Perhydrous coal
Vitrinite
Soluble material
Thermal extract
Trapped compounds
NMR
Py–GC/MS (Curie temperature: 350°C)
spellingShingle Perhydrous coal
Vitrinite
Soluble material
Thermal extract
Trapped compounds
NMR
Py–GC/MS (Curie temperature: 350°C)
Perhydrous coal
Vitrinite
Soluble material
Thermal extract
Trapped compounds
NMR
Py–GC/MS (Curie temperature: 350°C)
Iglesias, María José
Río Andrade, José Carlos del
Laggoun-Défarge, Fatima
Cuesta, María José
Suárez Ruiz, Isabel
Chemical-structural characterization of solvent and thermal extractable material from perhydrous vitrinites
description In this work, the characterization of the non-covalently bonded compounds present in a set of perhydrous coals of different age and geographical location (Cretaceous coals: UCV and TCV and Jurassic coals: AJV, PGJV, WJVh and WJVl) was carried out by means of a combination of the analyses of the material soluble in chloroform and the thermal extract. The extract in chloroform was studied through GC/MS and NMR and the thermovaporized fraction was obtained by means of flash pyrolysis at the Curie temperature of 350°C and quantified by on-line GC-MS. The results obtained for the Cretaceous coals confirm that the substances responsible for the hydrogenation are those covalently bonded to the vitrinite network as a result of the modifications undergone by the botanical precursors. Despite the striking similarity in the global characteristics of these two coals (TCV and UCV) significant differences between the material non-covalently bonded to their coal matrices were found. These differences are attributed to the type of resins present in the coals and/or to their different degree of evolution. With respect to the Jurassic coals, the present study allows the process by which the hydrogenated substances were assimilated into their structure to be established. The characterization of the assimilated substances in the WJVl coal reveals an unexpectedly high incorporation of alkanes given the humic origin of this sample. From these results the assimilation of hydrogen-rich substances from the decomposition of the organic remains in the sedimentary environment in which WJVl precursor were deposited, is proposed. The incorporation of products derived from the primary decomposition of organic material is not evident for the WJVh and AJV coals. The substances assimilated into the coal matrices show a higher aromaticity, the aromatic structures of WJVh being more condensed than those found in AJV. The compositional differences between them probably arise from the different source of the hydrogen-rich material. In the case of AJV coal the source was the adsorption of hydrocarbons generated and migrated from the Pliensbachian source-rocks whereas in WJVh, assimilated compounds come from the material generated by the thermal transformation (coalification) of the adjacent organic rocks of similar age. Finally, PGJV shows two types of non-covalently bonded compounds. Solvent extractable material is mainly composed of the first type of compounds, which is predominantly aliphatic in nature with a preponderance of alkanes. The second type of compounds is more aromatic and they are probably located in the close porosity of this coal. They are not accessible to chloroform but they are the most abundant in the thermal extract.
author2 European Commission
author_facet European Commission
Iglesias, María José
Río Andrade, José Carlos del
Laggoun-Défarge, Fatima
Cuesta, María José
Suárez Ruiz, Isabel
format artículo
topic_facet Perhydrous coal
Vitrinite
Soluble material
Thermal extract
Trapped compounds
NMR
Py–GC/MS (Curie temperature: 350°C)
author Iglesias, María José
Río Andrade, José Carlos del
Laggoun-Défarge, Fatima
Cuesta, María José
Suárez Ruiz, Isabel
author_sort Iglesias, María José
title Chemical-structural characterization of solvent and thermal extractable material from perhydrous vitrinites
title_short Chemical-structural characterization of solvent and thermal extractable material from perhydrous vitrinites
title_full Chemical-structural characterization of solvent and thermal extractable material from perhydrous vitrinites
title_fullStr Chemical-structural characterization of solvent and thermal extractable material from perhydrous vitrinites
title_full_unstemmed Chemical-structural characterization of solvent and thermal extractable material from perhydrous vitrinites
title_sort chemical-structural characterization of solvent and thermal extractable material from perhydrous vitrinites
publisher Elsevier
publishDate 2003
url http://hdl.handle.net/10261/2607
http://dx.doi.org/10.13039/501100000780
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