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Record W3007406837 · doi:10.3390/separations7010013

Evaluation of the Performance of Cryogen-Free Thermal Modulation-Based Comprehensive Two-Dimensional Gas Chromatography-Time-of-Flight Mass Spectrometry (GC×GC-TOFMS) for the Qualitative Analysis of a Complex Bitumen Sample

2020· article· en· W3007406837 on OpenAlex

Why this work is in the frame

A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.

affAt least one author lists a Canadian institution in the pinned OpenAlex snapshot.
fundA Canadian funder is recorded on the work.
aboutThe title or abstract carries a Canadian signal from the geographic lexicon.

Bibliographic record

VenueSeparations · 2020
Typearticle
Languageen
FieldChemistry
TopicPetroleum Processing and Analysis
Canadian institutionsUniversity of Waterloo
FundersNatural Sciences and Engineering Research Council of Canada
KeywordsMass spectrometryIon-mobility spectrometryTime-of-flight mass spectrometryTwo-dimensional gasGas chromatographyChemistryChromatographyGas chromatography–mass spectrometryAnalytical techniqueDiesel fuelPetrochemicalAnalytical Chemistry (journal)IonIonization

Abstract

fetched live from OpenAlex

Historically, one-dimensional gas chromatography combined with mass spectrometry (GC/MS) has been employed in the analysis of petrochemical samples such as diesel, crude oil and bitumen. With increasingly complex samples, obtaining detailed information can be difficult with this method due to the large number of coelutions. By implementing comprehensive two-dimensional gas chromatography time-of-flight mass spectrometry (GC×GC-TOFMS), the limitations of GC/MS can be overcome, due to the ability of this method to separate mixtures using two different separation mechanisms and obtain full mass spectra. Furthermore, this enables an investigation of biomarkers, compounds which aid in the identification of geological and environmental processes, potentially differentiating crude oil samples. Cryogenic-based thermal modulators are typically used for this application due to their superior focusing effect; however, some platforms require expensive cryogenic consumables. The solid-state modulator (SSM), a cryogen-free thermal platform, was employed for the first time for the group and biomarker analysis of Alberta oil sands bitumen. Evaluation of the SSM performance was based on published literature data on bitumen analysis. Extracted ion chromatograms (EIC) and molecular ion peaks were used for the confirmation of the groups’ and individual’s analytes. Identification of the characteristic biomarkers responsible for determining thermal maturity, source rock or oil origin was achieved. These results indicate the successful analysis of bitumen by consumable-free, solid-state modulation-based GC×GC-TOFMS.

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.

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)0.000
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: Simulation or modeling · Consensus signal: none
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.367
Threshold uncertainty score0.503

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.001
Bibliometrics0.0000.002
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 head0.062
GPT teacher head0.351
Teacher spread0.289 · 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