Quantification of cocaine and its adulterants by nuclear magnetic resonance spectroscopy without deuterated solvents (No-D qNMR)
In this study, a new method was developed to quantify cocaine and some adulterants (lidocaine, caffeine, phenacetin, procaine and benzocaine) using nuclear magnetic resonance spectroscopy without the use of deuterated solvents (No-D qNMR). No-D qNMR presents as main advantages: low cost (in comparis...
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creator | Rocha, Willy W. F Leite, Júlia de A Correia, Radigya M Tosato, Flávia Madeira, Natã C. L Filgueiras, Paulo R Lacerda, Valdemar Freitas, Jair C. C Romão, Wanderson Neto, Álvaro C |
description | In this study, a new method was developed to quantify cocaine and some adulterants (lidocaine, caffeine, phenacetin, procaine and benzocaine) using nuclear magnetic resonance spectroscopy without the use of deuterated solvents (No-D qNMR). No-D qNMR presents as main advantages: low cost (in comparison to the use of deuterated solvents), non-destructive and rapid analysis, and being able to detect non-volatile compounds. For analytical validation achievement, figures of merit such as selectivity and specificity, linearity, quantification limit, detection limit, accuracy, precision and robustness were obtained. The built models presented excellent precision (0.99), and LOD values which varied between 0.126 and 0.666 mg mL
−1
. With the purpose of verifying the predictive capacity of the models, 34 crack samples seized by the Civil Police of Espírito Santo State - Brazil were analyzed, and the average cocaine content found was around 17.5 wt%, which is in line with expectations (up to approximately 30 wt%). Moreover, 50 wt% of the samples contained phenacetin, 9 wt% caffeine, and 3 wt% procaine and lidocaine, while benzocaine wasn't identified.
A new analytical method was developed to quantify cocaine and some adulterants using nuclear magnetic resonance spectroscopy without the use of deuterated solvents. |
doi_str_mv | 10.1039/c7ay03000b |
format | Article |
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−1
. With the purpose of verifying the predictive capacity of the models, 34 crack samples seized by the Civil Police of Espírito Santo State - Brazil were analyzed, and the average cocaine content found was around 17.5 wt%, which is in line with expectations (up to approximately 30 wt%). Moreover, 50 wt% of the samples contained phenacetin, 9 wt% caffeine, and 3 wt% procaine and lidocaine, while benzocaine wasn't identified.
A new analytical method was developed to quantify cocaine and some adulterants using nuclear magnetic resonance spectroscopy without the use of deuterated solvents.</description><identifier>ISSN: 1759-9660</identifier><identifier>EISSN: 1759-9679</identifier><identifier>DOI: 10.1039/c7ay03000b</identifier><language>eng</language><publisher>Cambridge: Royal Society of Chemistry</publisher><subject>Acetanilide ; Adulterants ; Caffeine ; Cocaine ; Deuteration ; Lidocaine ; Linearity ; Magnetic resonance spectroscopy ; NMR ; Nondestructive testing ; Nuclear magnetic resonance ; Phenacetin ; Police ; Resonance ; Solvents ; Spectroscopy ; Spectrum analysis ; Volatile compounds</subject><ispartof>Analytical methods, 2018-01, Vol.1 (15), p.1685-1694</ispartof><rights>Copyright Royal Society of Chemistry 2018</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c318t-c82746559891dbc55c6e01561d68fa2c21f61a864202ed762b531afec8e0be093</citedby><cites>FETCH-LOGICAL-c318t-c82746559891dbc55c6e01561d68fa2c21f61a864202ed762b531afec8e0be093</cites><orcidid>0000-0002-4474-2474 ; 0000-0002-2254-6683</orcidid></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><link.rule.ids>314,776,780,27901,27902</link.rule.ids></links><search><creatorcontrib>Rocha, Willy W. F</creatorcontrib><creatorcontrib>Leite, Júlia de A</creatorcontrib><creatorcontrib>Correia, Radigya M</creatorcontrib><creatorcontrib>Tosato, Flávia</creatorcontrib><creatorcontrib>Madeira, Natã C. L</creatorcontrib><creatorcontrib>Filgueiras, Paulo R</creatorcontrib><creatorcontrib>Lacerda, Valdemar</creatorcontrib><creatorcontrib>Freitas, Jair C. C</creatorcontrib><creatorcontrib>Romão, Wanderson</creatorcontrib><creatorcontrib>Neto, Álvaro C</creatorcontrib><title>Quantification of cocaine and its adulterants by nuclear magnetic resonance spectroscopy without deuterated solvents (No-D qNMR)</title><title>Analytical methods</title><description>In this study, a new method was developed to quantify cocaine and some adulterants (lidocaine, caffeine, phenacetin, procaine and benzocaine) using nuclear magnetic resonance spectroscopy without the use of deuterated solvents (No-D qNMR). No-D qNMR presents as main advantages: low cost (in comparison to the use of deuterated solvents), non-destructive and rapid analysis, and being able to detect non-volatile compounds. For analytical validation achievement, figures of merit such as selectivity and specificity, linearity, quantification limit, detection limit, accuracy, precision and robustness were obtained. The built models presented excellent precision (<5%), linearity (>0.99), and LOD values which varied between 0.126 and 0.666 mg mL
−1
. With the purpose of verifying the predictive capacity of the models, 34 crack samples seized by the Civil Police of Espírito Santo State - Brazil were analyzed, and the average cocaine content found was around 17.5 wt%, which is in line with expectations (up to approximately 30 wt%). Moreover, 50 wt% of the samples contained phenacetin, 9 wt% caffeine, and 3 wt% procaine and lidocaine, while benzocaine wasn't identified.
A new analytical method was developed to quantify cocaine and some adulterants using nuclear magnetic resonance spectroscopy without the use of deuterated solvents.</description><subject>Acetanilide</subject><subject>Adulterants</subject><subject>Caffeine</subject><subject>Cocaine</subject><subject>Deuteration</subject><subject>Lidocaine</subject><subject>Linearity</subject><subject>Magnetic resonance spectroscopy</subject><subject>NMR</subject><subject>Nondestructive testing</subject><subject>Nuclear magnetic resonance</subject><subject>Phenacetin</subject><subject>Police</subject><subject>Resonance</subject><subject>Solvents</subject><subject>Spectroscopy</subject><subject>Spectrum analysis</subject><subject>Volatile compounds</subject><issn>1759-9660</issn><issn>1759-9679</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2018</creationdate><recordtype>article</recordtype><recordid>eNpFkb1PwzAQxS0EEqWwsCNZYgGkgJ00TjyW8imVIhAMTJFzuUCq1E5tB5SNP52UojLdDb_3TvceIYecnXMWyQtIVMcixli-RQY8iWUgRSK3N7tgu2TPuTljQkaCD8j3U6u0r8oKlK-MpqakYEBVGqnSBa28o6poa4-2xxzNO6pbqFFZulDvGn0F1KIzWmlA6hoEb40D03T0q_IfpvW0wHal9lhQZ-pPXNmczExwRZezh-fTfbJTqtrhwd8ckteb65fJXTB9vL2fjKcBRDz1AaRhMhJxLFPJixziGAQyHgteiLRUIYS8FFylYhSyEItEhHkccVUipMhyZDIakuO1b2PNskXns7lpre5PZr0k5Zwlo7CnztYU9G84i2XW2GqhbJdxlq0SzibJ-O034csePlrD1sGG-28g-gEEqHmg</recordid><startdate>20180101</startdate><enddate>20180101</enddate><creator>Rocha, Willy W. F</creator><creator>Leite, Júlia de A</creator><creator>Correia, Radigya M</creator><creator>Tosato, Flávia</creator><creator>Madeira, Natã C. L</creator><creator>Filgueiras, Paulo R</creator><creator>Lacerda, Valdemar</creator><creator>Freitas, Jair C. C</creator><creator>Romão, Wanderson</creator><creator>Neto, Álvaro C</creator><general>Royal Society of Chemistry</general><scope>AAYXX</scope><scope>CITATION</scope><scope>7QF</scope><scope>7QO</scope><scope>7QQ</scope><scope>7SE</scope><scope>7SR</scope><scope>7U5</scope><scope>8BQ</scope><scope>8FD</scope><scope>FR3</scope><scope>H8G</scope><scope>JG9</scope><scope>L7M</scope><scope>P64</scope><orcidid>https://orcid.org/0000-0002-4474-2474</orcidid><orcidid>https://orcid.org/0000-0002-2254-6683</orcidid></search><sort><creationdate>20180101</creationdate><title>Quantification of cocaine and its adulterants by nuclear magnetic resonance spectroscopy without deuterated solvents (No-D qNMR)</title><author>Rocha, Willy W. F ; Leite, Júlia de A ; Correia, Radigya M ; Tosato, Flávia ; Madeira, Natã C. L ; Filgueiras, Paulo R ; Lacerda, Valdemar ; Freitas, Jair C. C ; Romão, Wanderson ; Neto, Álvaro C</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c318t-c82746559891dbc55c6e01561d68fa2c21f61a864202ed762b531afec8e0be093</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2018</creationdate><topic>Acetanilide</topic><topic>Adulterants</topic><topic>Caffeine</topic><topic>Cocaine</topic><topic>Deuteration</topic><topic>Lidocaine</topic><topic>Linearity</topic><topic>Magnetic resonance spectroscopy</topic><topic>NMR</topic><topic>Nondestructive testing</topic><topic>Nuclear magnetic resonance</topic><topic>Phenacetin</topic><topic>Police</topic><topic>Resonance</topic><topic>Solvents</topic><topic>Spectroscopy</topic><topic>Spectrum analysis</topic><topic>Volatile compounds</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Rocha, Willy W. F</creatorcontrib><creatorcontrib>Leite, Júlia de A</creatorcontrib><creatorcontrib>Correia, Radigya M</creatorcontrib><creatorcontrib>Tosato, Flávia</creatorcontrib><creatorcontrib>Madeira, Natã C. L</creatorcontrib><creatorcontrib>Filgueiras, Paulo R</creatorcontrib><creatorcontrib>Lacerda, Valdemar</creatorcontrib><creatorcontrib>Freitas, Jair C. C</creatorcontrib><creatorcontrib>Romão, Wanderson</creatorcontrib><creatorcontrib>Neto, Álvaro C</creatorcontrib><collection>CrossRef</collection><collection>Aluminium Industry Abstracts</collection><collection>Biotechnology Research Abstracts</collection><collection>Ceramic Abstracts</collection><collection>Corrosion Abstracts</collection><collection>Engineered Materials Abstracts</collection><collection>Solid State and Superconductivity Abstracts</collection><collection>METADEX</collection><collection>Technology Research Database</collection><collection>Engineering Research Database</collection><collection>Copper Technical Reference Library</collection><collection>Materials Research Database</collection><collection>Advanced Technologies Database with Aerospace</collection><collection>Biotechnology and BioEngineering Abstracts</collection><jtitle>Analytical methods</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Rocha, Willy W. F</au><au>Leite, Júlia de A</au><au>Correia, Radigya M</au><au>Tosato, Flávia</au><au>Madeira, Natã C. L</au><au>Filgueiras, Paulo R</au><au>Lacerda, Valdemar</au><au>Freitas, Jair C. C</au><au>Romão, Wanderson</au><au>Neto, Álvaro C</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Quantification of cocaine and its adulterants by nuclear magnetic resonance spectroscopy without deuterated solvents (No-D qNMR)</atitle><jtitle>Analytical methods</jtitle><date>2018-01-01</date><risdate>2018</risdate><volume>1</volume><issue>15</issue><spage>1685</spage><epage>1694</epage><pages>1685-1694</pages><issn>1759-9660</issn><eissn>1759-9679</eissn><abstract>In this study, a new method was developed to quantify cocaine and some adulterants (lidocaine, caffeine, phenacetin, procaine and benzocaine) using nuclear magnetic resonance spectroscopy without the use of deuterated solvents (No-D qNMR). No-D qNMR presents as main advantages: low cost (in comparison to the use of deuterated solvents), non-destructive and rapid analysis, and being able to detect non-volatile compounds. For analytical validation achievement, figures of merit such as selectivity and specificity, linearity, quantification limit, detection limit, accuracy, precision and robustness were obtained. The built models presented excellent precision (<5%), linearity (>0.99), and LOD values which varied between 0.126 and 0.666 mg mL
−1
. With the purpose of verifying the predictive capacity of the models, 34 crack samples seized by the Civil Police of Espírito Santo State - Brazil were analyzed, and the average cocaine content found was around 17.5 wt%, which is in line with expectations (up to approximately 30 wt%). Moreover, 50 wt% of the samples contained phenacetin, 9 wt% caffeine, and 3 wt% procaine and lidocaine, while benzocaine wasn't identified.
A new analytical method was developed to quantify cocaine and some adulterants using nuclear magnetic resonance spectroscopy without the use of deuterated solvents.</abstract><cop>Cambridge</cop><pub>Royal Society of Chemistry</pub><doi>10.1039/c7ay03000b</doi><tpages>1</tpages><orcidid>https://orcid.org/0000-0002-4474-2474</orcidid><orcidid>https://orcid.org/0000-0002-2254-6683</orcidid></addata></record> |
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source | Royal Society Of Chemistry Journals 2008- |
subjects | Acetanilide Adulterants Caffeine Cocaine Deuteration Lidocaine Linearity Magnetic resonance spectroscopy NMR Nondestructive testing Nuclear magnetic resonance Phenacetin Police Resonance Solvents Spectroscopy Spectrum analysis Volatile compounds |
title | Quantification of cocaine and its adulterants by nuclear magnetic resonance spectroscopy without deuterated solvents (No-D qNMR) |
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