MétaCan
Menu
Back to cohort
Record W4308569958 · doi:10.1021/acs.jchemed.2c00501

Exploring the Composition and Authenticity of Honey and Syrup Samples Using Quantitative NMR Spectroscopy and Principal Component Analysis in an Upper-Year Undergraduate Analytical Environmental Course

2022· article· en· W4308569958 on OpenAlexafffund
Jeremy R. Gauthier, Darcy C. Burns, Jack Sheng, Jessica C. D’eon

Bibliographic record

VenueJournal of Chemical Education · 2022
Typearticle
Languageen
FieldBiochemistry, Genetics and Molecular Biology
TopicMetabolomics and Mass Spectrometry Studies
Canadian institutionsUniversity of Toronto
FundersUniversity of Toronto
KeywordsPrincipal component analysisChemometricsChemistrySample preparationSample (material)Nuclear magnetic resonance spectroscopyAnalytical Chemistry (journal)Biochemical engineeringChromatographyMathematicsStatisticsOrganic chemistry

Abstract

fetched live from OpenAlex

The adulteration of food products, including honeys and syrups, is of growing concern in global food markets. Detecting adulterated food products can be difficult using traditional analytical methodologies because of complex sample matrices or poor separation of key compounds. NMR is an analytical tool that circumvents some of these issues by providing a snapshot of chemical components in a sample mixture with minimal and unbiased sample preparation. In this upper-year undergraduate and graduate laboratory, students are introduced to NMR as an analytical tool through the analysis of a honey or syrup sample of their choice. Simple sugars in honeys or syrups are quantified using a single point internal standard, while the NMR signals arising from the complex organic mixture of amino acids, proteins, carbohydrates, and oils found in these syrups are compared against a sample data set using principal component analysis. The experiment highlights the benefits and challenges of NMR as an analytical tool, demonstrating the simplicity of sample preparation and single-point calibration, as well as the limitations of instrument sensitivity and signal resolving power.

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)0.000
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: Bench or experimental · Consensus signal: none
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.565
Threshold uncertainty score0.237

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
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 head0.043
GPT teacher head0.313
Teacher spread0.271 · 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

Citations12
Published2022
Admission routes2
Has abstractyes

Explore more

Same venueJournal of Chemical EducationSame topicMetabolomics and Mass Spectrometry StudiesFrench-language works237,207