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Updated: Jun 1, 2026

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Real-Time Quantitative Analysis of Combustion-Generated Polycyclic Aromatic Hydrocarbons by Resonance-Enhanced
C M Gittins1, M J Castaldi, S M Senkan
1Combustion Research Facility, Sandia National Laboratories, Mail Stop 9055, Livermore, California 94551, and Department of Chemical Engineering, University of California, Los Angeles, California 92004.
This study quantifies polycyclic aromatic hydrocarbons (PAHs) in methane flames using resonance-enhanced multiphoton ionization (REMPI) mass spectrometry. The method accurately measures naphthalene, fluorene, and anthracene concentrations in real-time.
Area of Science:
- Analytical Chemistry
- Combustion Science
- Physical Chemistry
Background:
- Polycyclic aromatic hydrocarbons (PAHs) are significant combustion byproducts.
- Accurate measurement of PAHs in flames is crucial for understanding combustion processes and emissions.
Purpose of the Study:
- To develop and apply a method for real-time quantification of specific PAHs in a methane diffusion flame.
- To determine the concentrations of naphthalene, fluorene, and anthracene using advanced spectroscopic techniques.
Main Methods:
- Combined resonance-enhanced multiphoton ionization (REMPI) time-of-flight mass spectrometry with on-line flame sampling.
- Utilized one-color REMPI for naphthalene and fluorene, and two-color REMPI for anthracene detection.
- Employed gas-phase standard additions for real-time absolute concentration calibration.
Main Results:
- Measured naphthalene concentrations from 100 ppbV to 6 ppmV.
- Quantified fluorene concentrations below 50 ppbV.
- Determined anthracene concentrations in the 5-40 ppbV range.
- Demonstrated isomer-selective detection of larger PAHs like perylene and benzo[a]pyrene.
Conclusions:
- The developed REMPI-MS method provides accurate, real-time quantification of PAHs in flames.
- This technique is valuable for studying PAH formation and speciation in combustion environments.
- The method shows potential for detecting a wide range of PAHs, including larger, more complex molecules.
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