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Record W4404055216 · doi:10.1016/j.chroma.2024.465504

Method development and comprehensive study of matrix effects for the determination of trace organic contaminants in lake sediments

2024· article· en· W4404055216 on OpenAlexaffabout
François-Xavier Teysseire, Hubert Cabana, Pedro A. Segura

Bibliographic record

VenueJournal of Chromatography A · 2024
Typearticle
Languageen
FieldChemistry
TopicAnalytical chemistry methods development
Canadian institutionsUniversité de Sherbrooke
Fundersnot available
KeywordsChemistryTRACE (psycholinguistics)Environmental chemistryMatrix (chemical analysis)ContaminationChromatographyComplex matrixEcology

Abstract

fetched live from OpenAlex

• Diatomaceous earth was the optimal dispersant for pressurized liquid extraction • Two successive extractions with MeOH and a MeOH-H 2 O mix gave the best recoveries • Matrix effects increased with organic matter and were highly correlated with retention time • Addition of internal standards was the most efficient technique to correct matrix effects • 17 compounds were quantified in 10 small to medium-sized lakes in Quebec, Canada The presence of trace organic contaminants (TrOCs), such as pharmaceuticals, personal care products, additives, and polar pesticides in sediments of rivers and lakes highly impacted by anthropogenic activities makes sediments a secondary source of contamination for aquatic ecosystems. Considering this, a method for analyzing 44 TrOCs of diverse nature (including five transformation products, 13 pharmaceuticals, five personal care products, 14 pesticides, and seven additives) was developed and validated. It is based on extraction by pressurized liquid extraction (PLE), followed by purification and pre-concentration by solid phase extraction (SPE) and quantification by liquid chromatography coupled to a triple quadrupole mass spectrometer (LC-QqQMS). The method was optimized according to dispersant type, temperature, and extraction solvent. The influence of organic matter in sediments on quantitative analysis was also investigated in detail. Matrix effects were highly and significantly correlated ( r =-0.9146, p < 0.0001) with retention time. Using internal standards showed the best results for effectively correcting matrix effects without affecting method sensitivity. The method was then validated according to key figures of merit: linearity ( R 2 > 0.990), extraction recoveries (> 60% for 34 compounds), trueness (bias % < 15%), precision (relative standard deviation < 20%) and matrix effects (between -13.3% and 17.8%). This method can be applied for routine analysis of TrOCs in different sediment matrices. The method was applied to ten lake sediment samples collected in Québec, Canada. Results demonstrated the presence of 17 compounds in at least one lake at concentrations between 0.07 to 1531 ng g -1 . The reported concentrations provide a first picture of the occurrence of chemical stressors in sediments of small lake highly anthropized ecosystems in Eastern Canada.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.001
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.087
Threshold uncertainty score0.446

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0000.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.019
GPT teacher head0.334
Teacher spread0.315 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one teacher head, not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations8
Published2024
Admission routes2
Has abstractyes

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