Investigation of pharmaceuticals and illicit drugs in waters by liquid chromatography-high-resolution mass spectrometry

•Overview of LC-HRMS in investigating illicit drugs and pharmaceuticals in waters.•We consider time-of-flight (TOF) and Orbitrap mass analyzers.•We discuss the benefits of using UHPLC in combination with HRMS.•Target, suspect and non-target screening can be performed with the same instrument.•Retros...

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Published inTrAC, Trends in analytical chemistry (Regular ed.) Vol. 63; pp. 140 - 157
Main Authors Hernández, F., Ibáñez, M., Bade, R., Bijlsma, L., Sancho, J.V.
Format Journal Article
LanguageEnglish
Published Elsevier B.V 01.12.2014
Subjects
Emerging contaminant
High-resolution mass spectrometry (HRMS)
Illicit drug
LC-HRMS
Liquid chromatography (LC)
Orbitrap
Pharmaceutical
Screening
Time of flight
Transformation product
High-resolution mass spectrometry (HRMS)
Screening
Emerging contaminant
Illicit drug
Liquid chromatography (LC)
Time of flight
Orbitrap
Pharmaceutical
LC-HRMS
Transformation product
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Abstract •Overview of LC-HRMS in investigating illicit drugs and pharmaceuticals in waters.•We consider time-of-flight (TOF) and Orbitrap mass analyzers.•We discuss the benefits of using UHPLC in combination with HRMS.•Target, suspect and non-target screening can be performed with the same instrument.•Retrospective analysis and discovery of transformation/degradation products. Mass spectrometry (MS) coupled to chromatography has been increasingly used in the environmental field, as it allows the best performance currently attainable for the investigation of a wide range of organic pollutants. When dealing with emerging contaminants, there is a clear trend towards the use of liquid chromatography-mass spectrometry (LC-MS) techniques, from tandem (low-resolution) MS to high-resolution (HR) MS. HRMS allows targeted and untargeted analysis, thanks to full-spectrum acquisition at high mass accuracy with good sensitivity. With the same instrument, target, suspect and non-target screening can be performed, as can retrospective analysis and discovery of transformation/degradation products. This article gives a general overview on the use of HRMS in LC-based methods directed towards the investigation of illicit drugs and pharmaceuticals in the aqueous environment. We consider time-of-flight and Orbitrap mass analyzers, and we discuss the benefits of using ultra-high-performance liquid chromatography (UHPLC) in combination with HRMS.
AbstractList •Overview of LC-HRMS in investigating illicit drugs and pharmaceuticals in waters.•We consider time-of-flight (TOF) and Orbitrap mass analyzers.•We discuss the benefits of using UHPLC in combination with HRMS.•Target, suspect and non-target screening can be performed with the same instrument.•Retrospective analysis and discovery of transformation/degradation products. Mass spectrometry (MS) coupled to chromatography has been increasingly used in the environmental field, as it allows the best performance currently attainable for the investigation of a wide range of organic pollutants. When dealing with emerging contaminants, there is a clear trend towards the use of liquid chromatography-mass spectrometry (LC-MS) techniques, from tandem (low-resolution) MS to high-resolution (HR) MS. HRMS allows targeted and untargeted analysis, thanks to full-spectrum acquisition at high mass accuracy with good sensitivity. With the same instrument, target, suspect and non-target screening can be performed, as can retrospective analysis and discovery of transformation/degradation products. This article gives a general overview on the use of HRMS in LC-based methods directed towards the investigation of illicit drugs and pharmaceuticals in the aqueous environment. We consider time-of-flight and Orbitrap mass analyzers, and we discuss the benefits of using ultra-high-performance liquid chromatography (UHPLC) in combination with HRMS.
Author Bade, R.
Sancho, J.V.
Ibáñez, M.
Bijlsma, L.
Hernández, F.
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  surname: Ibáñez
  fullname: Ibáñez, M.
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  givenname: R.
  surname: Bade
  fullname: Bade, R.
– sequence: 4
  givenname: L.
  surname: Bijlsma
  fullname: Bijlsma, L.
– sequence: 5
  givenname: J.V.
  surname: Sancho
  fullname: Sancho, J.V.
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Keywords High-resolution mass spectrometry (HRMS)
Screening
Emerging contaminant
Illicit drug
Liquid chromatography (LC)
Time of flight
Orbitrap
Pharmaceutical
LC-HRMS
Transformation product
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Snippet •Overview of LC-HRMS in investigating illicit drugs and pharmaceuticals in waters.•We consider time-of-flight (TOF) and Orbitrap mass analyzers.•We discuss the...
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SubjectTerms Emerging contaminant
High-resolution mass spectrometry (HRMS)
Illicit drug
LC-HRMS
Liquid chromatography (LC)
Orbitrap
Pharmaceutical
Screening
Time of flight
Transformation product
Title Investigation of pharmaceuticals and illicit drugs in waters by liquid chromatography-high-resolution mass spectrometry
URI https://dx.doi.org/10.1016/j.trac.2014.08.003
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