Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry
Autor(a) principal: | |
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Data de Publicação: | 2021 |
Outros Autores: | , , , , |
Tipo de documento: | Artigo |
Idioma: | eng |
Título da fonte: | Repositório Institucional da UnB |
Texto Completo: | http://repositorio2.unb.br/jspui/handle/10482/47742 https://doi.org/10.1016/j.chroma.2020.461783 |
Resumo: | New Psychoactive Substances (NPS) are quickly developing to evade legislation, posing unprecedented challenges to public health and law enforcement authorities around the world. The aim of this work was to develop and validate a simple and reliable non-target gas chromatography/mass spectrometry (GC/MS) analytical method based on linear retention indexes for the expeditious identification of NPS without the need of analytical standards. The method was optimized and validated for 22 different drugs covering ten categories: phenethylamines (amphetamine, MDMA, methamphetamine, 25C–NBOMe, 2-FA, 5-MAPB), “classic” drugs (cocaine, ephedrine, THC, heroine), synthetic cannabinoids (JWH-081, AM-2201, JWH-210, MAM-2201), piperazines (o-CPP, p-CPP), tryptamines (5-MeO-MiPT), synthetic cathinones (N ethylpentylone), synthetic opioids (U-47700), aminoindanes (5-IAI), plant-based substances (Salvinorin-A) and “other” (methiopropamine). Three figures of merit (Selectivity, Precision and Robustness) were eval uated with retention index confidence intervals ranging from 0.5 to 20.6 i.u. and relative standard de viations in the range of 0.003% to 0.027% (repeatability) and 0.02% to 0.29% (intermediate precision). A general equation for estimating linear retention index variation as a function of retention time tolerance has been derived. This result in combination with a 26−3 III fractional factorial design allowed to conclude column polarity to be only statistically relevant factor as compared to gas flow, split ratio, injection tem perature, temperature program offset and column brand. |
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Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometryCromatografia gasosaEspectrometria de massaSubstâncias psicoativasNew Psychoactive Substances (NPS) are quickly developing to evade legislation, posing unprecedented challenges to public health and law enforcement authorities around the world. The aim of this work was to develop and validate a simple and reliable non-target gas chromatography/mass spectrometry (GC/MS) analytical method based on linear retention indexes for the expeditious identification of NPS without the need of analytical standards. The method was optimized and validated for 22 different drugs covering ten categories: phenethylamines (amphetamine, MDMA, methamphetamine, 25C–NBOMe, 2-FA, 5-MAPB), “classic” drugs (cocaine, ephedrine, THC, heroine), synthetic cannabinoids (JWH-081, AM-2201, JWH-210, MAM-2201), piperazines (o-CPP, p-CPP), tryptamines (5-MeO-MiPT), synthetic cathinones (N ethylpentylone), synthetic opioids (U-47700), aminoindanes (5-IAI), plant-based substances (Salvinorin-A) and “other” (methiopropamine). Three figures of merit (Selectivity, Precision and Robustness) were eval uated with retention index confidence intervals ranging from 0.5 to 20.6 i.u. and relative standard de viations in the range of 0.003% to 0.027% (repeatability) and 0.02% to 0.29% (intermediate precision). A general equation for estimating linear retention index variation as a function of retention time tolerance has been derived. This result in combination with a 26−3 III fractional factorial design allowed to conclude column polarity to be only statistically relevant factor as compared to gas flow, split ratio, injection tem perature, temperature program offset and column brand.Instituto de Química (IQ)Programa de Pós-Graduação em QuímicaElsevier B.V.Brazilian Federal Police, National Institute of CriminalisticsBrazilian Health Regulatory AgencyUniversity of Brasília, Institute of ChemistryBrazilian Federal Police, National Institute of CriminalisticsBrazilian Federal Police, National Institute of CriminalisticsBrazilian Federal Police, National Institute of CriminalisticsUniversity of Brasília, Institute of ChemistryZacca, Jorge JardimGiudice, Gabriella HamúSouza, Mônica P.Caldas, Luíza N. B.Vieira, Maurício L.Machado, Ângelo Henirque de Lira2024-02-15T15:18:49Z2024-02-15T15:18:49Z2021info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articleZACCA, Jorge J. et al. Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry. Journal of Chromatography A, [S. l.], v. 1636, 461783, 11 jan. 2021. DOI: https://doi.org/10.1016/j.chroma.2020.461783http://repositorio2.unb.br/jspui/handle/10482/47742https://doi.org/10.1016/j.chroma.2020.461783enghttps://www.sciencedirect.com/science/article/pii/S0021967320310578?via%3Dihubinfo:eu-repo/semantics/openAccessreponame:Repositório Institucional da UnBinstname:Universidade de Brasília (UnB)instacron:UNB2024-02-15T15:35:36Zoai:repositorio.unb.br:10482/47742Repositório InstitucionalPUBhttps://repositorio.unb.br/oai/requestrepositorio@unb.bropendoar:2024-02-15T15:35:36Repositório Institucional da UnB - Universidade de Brasília (UnB)false |
dc.title.none.fl_str_mv |
Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry |
title |
Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry |
spellingShingle |
Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry Zacca, Jorge Jardim Cromatografia gasosa Espectrometria de massa Substâncias psicoativas |
title_short |
Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry |
title_full |
Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry |
title_fullStr |
Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry |
title_full_unstemmed |
Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry |
title_sort |
Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry |
author |
Zacca, Jorge Jardim |
author_facet |
Zacca, Jorge Jardim Giudice, Gabriella Hamú Souza, Mônica P. Caldas, Luíza N. B. Vieira, Maurício L. Machado, Ângelo Henirque de Lira |
author_role |
author |
author2 |
Giudice, Gabriella Hamú Souza, Mônica P. Caldas, Luíza N. B. Vieira, Maurício L. Machado, Ângelo Henirque de Lira |
author2_role |
author author author author author |
dc.contributor.none.fl_str_mv |
Brazilian Federal Police, National Institute of Criminalistics Brazilian Health Regulatory Agency University of Brasília, Institute of Chemistry Brazilian Federal Police, National Institute of Criminalistics Brazilian Federal Police, National Institute of Criminalistics Brazilian Federal Police, National Institute of Criminalistics University of Brasília, Institute of Chemistry |
dc.contributor.author.fl_str_mv |
Zacca, Jorge Jardim Giudice, Gabriella Hamú Souza, Mônica P. Caldas, Luíza N. B. Vieira, Maurício L. Machado, Ângelo Henirque de Lira |
dc.subject.por.fl_str_mv |
Cromatografia gasosa Espectrometria de massa Substâncias psicoativas |
topic |
Cromatografia gasosa Espectrometria de massa Substâncias psicoativas |
description |
New Psychoactive Substances (NPS) are quickly developing to evade legislation, posing unprecedented challenges to public health and law enforcement authorities around the world. The aim of this work was to develop and validate a simple and reliable non-target gas chromatography/mass spectrometry (GC/MS) analytical method based on linear retention indexes for the expeditious identification of NPS without the need of analytical standards. The method was optimized and validated for 22 different drugs covering ten categories: phenethylamines (amphetamine, MDMA, methamphetamine, 25C–NBOMe, 2-FA, 5-MAPB), “classic” drugs (cocaine, ephedrine, THC, heroine), synthetic cannabinoids (JWH-081, AM-2201, JWH-210, MAM-2201), piperazines (o-CPP, p-CPP), tryptamines (5-MeO-MiPT), synthetic cathinones (N ethylpentylone), synthetic opioids (U-47700), aminoindanes (5-IAI), plant-based substances (Salvinorin-A) and “other” (methiopropamine). Three figures of merit (Selectivity, Precision and Robustness) were eval uated with retention index confidence intervals ranging from 0.5 to 20.6 i.u. and relative standard de viations in the range of 0.003% to 0.027% (repeatability) and 0.02% to 0.29% (intermediate precision). A general equation for estimating linear retention index variation as a function of retention time tolerance has been derived. This result in combination with a 26−3 III fractional factorial design allowed to conclude column polarity to be only statistically relevant factor as compared to gas flow, split ratio, injection tem perature, temperature program offset and column brand. |
publishDate |
2021 |
dc.date.none.fl_str_mv |
2021 2024-02-15T15:18:49Z 2024-02-15T15:18:49Z |
dc.type.status.fl_str_mv |
info:eu-repo/semantics/publishedVersion |
dc.type.driver.fl_str_mv |
info:eu-repo/semantics/article |
format |
article |
status_str |
publishedVersion |
dc.identifier.uri.fl_str_mv |
ZACCA, Jorge J. et al. Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry. Journal of Chromatography A, [S. l.], v. 1636, 461783, 11 jan. 2021. DOI: https://doi.org/10.1016/j.chroma.2020.461783 http://repositorio2.unb.br/jspui/handle/10482/47742 https://doi.org/10.1016/j.chroma.2020.461783 |
identifier_str_mv |
ZACCA, Jorge J. et al. Development and validation of analytical method for identification of new psychoactive substances using linear retention indexes and gas chromatography-mass spectrometry. Journal of Chromatography A, [S. l.], v. 1636, 461783, 11 jan. 2021. DOI: https://doi.org/10.1016/j.chroma.2020.461783 |
url |
http://repositorio2.unb.br/jspui/handle/10482/47742 https://doi.org/10.1016/j.chroma.2020.461783 |
dc.language.iso.fl_str_mv |
eng |
language |
eng |
dc.relation.none.fl_str_mv |
https://www.sciencedirect.com/science/article/pii/S0021967320310578?via%3Dihub |
dc.rights.driver.fl_str_mv |
info:eu-repo/semantics/openAccess |
eu_rights_str_mv |
openAccess |
dc.publisher.none.fl_str_mv |
Elsevier B.V. |
publisher.none.fl_str_mv |
Elsevier B.V. |
dc.source.none.fl_str_mv |
reponame:Repositório Institucional da UnB instname:Universidade de Brasília (UnB) instacron:UNB |
instname_str |
Universidade de Brasília (UnB) |
instacron_str |
UNB |
institution |
UNB |
reponame_str |
Repositório Institucional da UnB |
collection |
Repositório Institucional da UnB |
repository.name.fl_str_mv |
Repositório Institucional da UnB - Universidade de Brasília (UnB) |
repository.mail.fl_str_mv |
repositorio@unb.br |
_version_ |
1814508366771257344 |