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Exploring 1H NMR relaxometry for wine traceability and authenticity assessment

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Resumo:The development of analytical methodologies for wine authenticity assessment is one of the most challenging issues for the scientific community. In this study, the potential analytical applications of 1H NMR relaxometry, in view to wine authenticity investigation, were explored. For that, proton longitudinal relaxation rate dispersions in the range 0.04-300 MHz were investigated in three white and three red varietal wines from Tapada da Ajuda (Lisbon), obtained from Vitis vinifera L. grape varieties, namely Alvarinho, Arinto, Cabernet Sauvignon, Moscatel Graúdo, Touriga Nacional and Trincadeira, from vintages 2008 and 2017 for a total of twelve bottles. To evaluate rain as an environmental source of variability pluviometric data were considered. Dispersions associable to the presence of paramagnetic ions were observed at low frequencies but the results for wine iron content cannot explain the effect. Correlations between the wine characters and the areas drawn by the most representative relaxometry models show an effect of alcoholic strength by volume, glycerol and total dry matter suggesting wine viscosity to modulate relaxivity. To the best of our knowledge, for the first time wine physical-chemical characteristics and glycerol content have been compared to NMR relaxation rate profiles. To investigate the paramagnetic relaxation and evaluate the relaxation associated to wine hydro-alcoholic matrix, water-ethanol mixtures were tested, and linear regressions were obtained. Comparing the results with bibliographic sources, the paramagnetic enhancement on relaxation profiles was associated to the presence of manganese(II), but no parameters have been fitted from the models. The dispersions highlighted possible cross relaxations in the 1.5-6 MHz frequency range. The presence of nitrogen diluted into the wine could explain this behaviour. To inspect how each physical-chemical parameter impacts on wine relaxation profiles the knowledge of manganese content is crucial
Autores principais:Zava, Andrea
Assunto:authenticity isotopes NMR relaxometry wine
Ano:2020
País:Portugal
Tipo de documento:dissertação de mestrado
Tipo de acesso:acesso aberto
Instituição associada:Universidade de Lisboa
Idioma:inglês
Origem:Repositório da Universidade de Lisboa
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author Zava, Andrea
author_facet Zava, Andrea
author_role author
contributor_name_str_mv Catarino, Sofia
Sebastião, Pedro Oliveira
Repositório Científico de Acesso Aberto da ULisboa
country_str PT
creators_json_txt [{\"Person.name\":\"Zava, Andrea\"}]
datacite.contributors.contributor.contributorName.fl_str_mv Catarino, Sofia
Sebastião, Pedro Oliveira
Repositório Científico de Acesso Aberto da ULisboa
datacite.creators.creator.creatorName.fl_str_mv Zava, Andrea
datacite.date.Accepted.fl_str_mv 2020-01-01T00:00:00Z
datacite.date.available.fl_str_mv 2022-09-08T15:24:04Z
datacite.date.embargoed.fl_str_mv 2022-09-08T15:24:04Z
datacite.rights.fl_str_mv http://purl.org/coar/access_right/c_abf2
datacite.subjects.subject.fl_str_mv authenticity
isotopes
NMR
relaxometry
wine
datacite.titles.title.fl_str_mv Exploring 1H NMR relaxometry for wine traceability and authenticity assessment
dc.contributor.none.fl_str_mv Catarino, Sofia
Sebastião, Pedro Oliveira
Repositório Científico de Acesso Aberto da ULisboa
dc.creator.none.fl_str_mv Zava, Andrea
dc.date.Accepted.fl_str_mv 2020-01-01T00:00:00Z
dc.date.available.fl_str_mv 2022-09-08T15:24:04Z
dc.date.embargoed.fl_str_mv 2022-09-08T15:24:04Z
dc.format.none.fl_str_mv application/pdf
dc.identifier.none.fl_str_mv http://hdl.handle.net/10400.5/25442
dc.language.none.fl_str_mv eng
dc.publisher.none.fl_str_mv s.n.
dc.rights.none.fl_str_mv http://purl.org/coar/access_right/c_abf2
dc.subject.none.fl_str_mv authenticity
isotopes
NMR
relaxometry
wine
dc.title.fl_str_mv Exploring 1H NMR relaxometry for wine traceability and authenticity assessment
dc.type.none.fl_str_mv http://purl.org/coar/resource_type/c_bdcc
description The development of analytical methodologies for wine authenticity assessment is one of the most challenging issues for the scientific community. In this study, the potential analytical applications of 1H NMR relaxometry, in view to wine authenticity investigation, were explored. For that, proton longitudinal relaxation rate dispersions in the range 0.04-300 MHz were investigated in three white and three red varietal wines from Tapada da Ajuda (Lisbon), obtained from Vitis vinifera L. grape varieties, namely Alvarinho, Arinto, Cabernet Sauvignon, Moscatel Graúdo, Touriga Nacional and Trincadeira, from vintages 2008 and 2017 for a total of twelve bottles. To evaluate rain as an environmental source of variability pluviometric data were considered. Dispersions associable to the presence of paramagnetic ions were observed at low frequencies but the results for wine iron content cannot explain the effect. Correlations between the wine characters and the areas drawn by the most representative relaxometry models show an effect of alcoholic strength by volume, glycerol and total dry matter suggesting wine viscosity to modulate relaxivity. To the best of our knowledge, for the first time wine physical-chemical characteristics and glycerol content have been compared to NMR relaxation rate profiles. To investigate the paramagnetic relaxation and evaluate the relaxation associated to wine hydro-alcoholic matrix, water-ethanol mixtures were tested, and linear regressions were obtained. Comparing the results with bibliographic sources, the paramagnetic enhancement on relaxation profiles was associated to the presence of manganese(II), but no parameters have been fitted from the models. The dispersions highlighted possible cross relaxations in the 1.5-6 MHz frequency range. The presence of nitrogen diluted into the wine could explain this behaviour. To inspect how each physical-chemical parameter impacts on wine relaxation profiles the knowledge of manganese content is crucial
dirty 0
eu_rights_str_mv openAccess
format masterThesis
fulltext.url.fl_str_mv https://repositorio.ulisboa.pt/bitstreams/328991cf-f204-4cf2-b594-f26e09f08cc6/download
id ul_0c3d00a2e139d67da30d4ece522e9211
identifier.url.fl_str_mv http://hdl.handle.net/10400.5/25442
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institution Universidade de Lisboa
instname_str Universidade de Lisboa
language eng
network_acronym_str ul
network_name_str Repositório da Universidade de Lisboa
oai_identifier_str oai:repositorio.ulisboa.pt:10400.5/25442
organization_str_mv urn:organizationAcronym:ul
person_str_mv Zava, Andrea
publishDate 2020
publisher.none.fl_str_mv s.n.
reponame_str Repositório da Universidade de Lisboa
repository_id_str urn:repositoryAcronym:ul
service_str_mv urn:repositoryAcronym:ul
spelling engs.n.pt_PTThe development of analytical methodologies for wine authenticity assessment is one of the most challenging issues for the scientific community. In this study, the potential analytical applications of 1H NMR relaxometry, in view to wine authenticity investigation, were explored. For that, proton longitudinal relaxation rate dispersions in the range 0.04-300 MHz were investigated in three white and three red varietal wines from Tapada da Ajuda (Lisbon), obtained from Vitis vinifera L. grape varieties, namely Alvarinho, Arinto, Cabernet Sauvignon, Moscatel Graúdo, Touriga Nacional and Trincadeira, from vintages 2008 and 2017 for a total of twelve bottles. To evaluate rain as an environmental source of variability pluviometric data were considered. Dispersions associable to the presence of paramagnetic ions were observed at low frequencies but the results for wine iron content cannot explain the effect. Correlations between the wine characters and the areas drawn by the most representative relaxometry models show an effect of alcoholic strength by volume, glycerol and total dry matter suggesting wine viscosity to modulate relaxivity. To the best of our knowledge, for the first time wine physical-chemical characteristics and glycerol content have been compared to NMR relaxation rate profiles. To investigate the paramagnetic relaxation and evaluate the relaxation associated to wine hydro-alcoholic matrix, water-ethanol mixtures were tested, and linear regressions were obtained. Comparing the results with bibliographic sources, the paramagnetic enhancement on relaxation profiles was associated to the presence of manganese(II), but no parameters have been fitted from the models. The dispersions highlighted possible cross relaxations in the 1.5-6 MHz frequency range. The presence of nitrogen diluted into the wine could explain this behaviour. To inspect how each physical-chemical parameter impacts on wine relaxation profiles the knowledge of manganese content is crucialapplication/pdfpt_PTExploring 1H NMR relaxometry for wine traceability and authenticity assessmentZava, AndreaCatarino, SofiaSebastião, Pedro OliveiraHostingInstitutionOrganizationalRepositório Científico de Acesso Aberto da ULisboae-mailmailto:repositorio@reitoria.ulisboa.ptrepositorio@reitoria.ulisboa.ptURNurn:tid:2030807182022-09-08T15:24:04Z20202020-01-01T00:00:00ZHandlehttp://hdl.handle.net/10400.5/25442http://purl.org/coar/access_right/c_abf2open accessauthenticityisotopesNMRrelaxometrywine2817130 bytesliteraturehttp://purl.org/coar/resource_type/c_bdccmaster thesishttp://purl.org/coar/access_right/c_abf2application/pdffulltexthttps://repositorio.ulisboa.pt/bitstreams/328991cf-f204-4cf2-b594-f26e09f08cc6/download
spellingShingle Exploring 1H NMR relaxometry for wine traceability and authenticity assessment
Zava, Andrea
authenticity
isotopes
NMR
relaxometry
wine
status SINGLETON
subject.fl_str_mv authenticity
isotopes
NMR
relaxometry
wine
title Exploring 1H NMR relaxometry for wine traceability and authenticity assessment
title_full Exploring 1H NMR relaxometry for wine traceability and authenticity assessment
title_fullStr Exploring 1H NMR relaxometry for wine traceability and authenticity assessment
title_full_unstemmed Exploring 1H NMR relaxometry for wine traceability and authenticity assessment
title_short Exploring 1H NMR relaxometry for wine traceability and authenticity assessment
title_sort Exploring 1H NMR relaxometry for wine traceability and authenticity assessment
topic authenticity
isotopes
NMR
relaxometry
wine
topic_facet authenticity
isotopes
NMR
relaxometry
wine
url http://hdl.handle.net/10400.5/25442
visible 1