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Chromatographic Fingerprinting by Template Matching for Data Collected by Comprehensive Two-Dimensional Gas Chromatography
Published on: September 2, 2020
Identification of gasoline adulteration using comprehensive two-dimensional gas chromatography combined to
Marcio Pozzobon Pedroso1, Luiz Antonio Fonseca de Godoy, Ernesto Correa Ferreira
1Institute of Chemistry, State University of Campinas (Unicamp), CP 6154, 13084-971 Campinas, São Paulo, Brazil.
This study introduces a new method using comprehensive two-dimensional gas chromatography (GCxGC-FID) and multi-way partial least squares regression (N-PLS) to detect gasoline adulteration. The technique accurately quantifies fuel blends, offering a reliable alternative for quality control.
Area of Science:
- Analytical Chemistry
- Petroleum Science
- Environmental Monitoring
Background:
- Commercial gasoline in Brazil (Type C) contains 25% ethanol, making it susceptible to adulteration.
- Accurate detection of fuel adulterants is crucial for quality control and regulatory compliance.
- Existing methods may not be sufficient for complex fuel mixtures.
Purpose of the Study:
- To develop and validate a method for detecting adulteration in commercial Type C gasoline.
- To correlate chromatographic data with gasoline concentration using multivariate calibration.
- To establish GCxGC-FID and N-PLS as a viable alternative for routine fuel analysis.
Main Methods:
- Utilized comprehensive two-dimensional gas chromatography with flame ionization detection (GCxGC-FID) for detailed sample analysis.
- Employed multi-way partial least squares regression (N-PLS) for multivariate calibration and quantitative modeling.
- Calibrated models using blends of gasoline with white spirit, kerosene, and paint thinner; validated with spiked samples and real-world gasoline.
Main Results:
- Regression models successfully correlated chromatographic data with gasoline concentration.
- Root mean square error of prediction (RMSEP) for gasoline concentration ranged from 3.3% to 8.2% (v/v).
- Results from the developed method showed agreement with the official analysis method for real fuel samples.
Conclusions:
- GCxGC-FID combined with N-PLS provides an effective method for detecting and quantifying gasoline adulteration.
- This approach offers a reliable alternative for routine monitoring of fuel quality.
- The method is applicable to other analytical challenges involving the detection of specific components in complex mixtures.
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