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Determination of three previously unidentified polycyclic aromatic hydrocarbons of molecular mass 302 Da in particulate Standard Reference Materials (SRMs) and combustion-related samples

Sadiktsis, Ioannis LU ; Malmborg, Vilhelm B. LU orcid ; Campiglia, Andres D. ; Uribe-Romo, Fernando J. and Wise, Stephen A. (2026) In Analytical and Bioanalytical Chemistry
Abstract

Polycyclic aromatic hydrocarbons (PAHs) of molecular mass (MM) 302 Da comprise numerous structural isomers that are of high concern for human health. Because of their multiplicity, low abundance in the environment, and limited availability of authentic standards, their occurrence, composition, and environmental health risk remain not well characterized. Here we extend the characterization of MM 302 Da PAH isomers in combustion-related particulate matter with the addition of four newly synthesized and previously unidentified MM 302 Da isomers: dibenzo[a,l]fluoranthene (DBalF), dibenzo[b,l]fluoranthene (DBblF), dibenzo[a,j]fluoranthene (DBajF), and naphtho[2,1-j]fluoranthene (N21jF). Using a coupled high-performance liquid... (More)

Polycyclic aromatic hydrocarbons (PAHs) of molecular mass (MM) 302 Da comprise numerous structural isomers that are of high concern for human health. Because of their multiplicity, low abundance in the environment, and limited availability of authentic standards, their occurrence, composition, and environmental health risk remain not well characterized. Here we extend the characterization of MM 302 Da PAH isomers in combustion-related particulate matter with the addition of four newly synthesized and previously unidentified MM 302 Da isomers: dibenzo[a,l]fluoranthene (DBalF), dibenzo[b,l]fluoranthene (DBblF), dibenzo[a,j]fluoranthene (DBajF), and naphtho[2,1-j]fluoranthene (N21jF). Using a coupled high-performance liquid chromatography/gas chromatography-mass spectrometric system with a 50% phenyl methylpolysiloxane stationary phase, 24 MM 302 Da isomers were annotated in four Standard Reference Materials, SRM 1648a, SRM 1649b, SRM 1650b, and SRM 2975, and in four combustion-related particulate matter samples consisting of two traffic-impacted filters and two laboratory-generated combustion samples. Three of the four previously unidentified compounds, DBalF, DBajF, and N21jF, were chromatographically resolved and quantified for the first time in these samples. Quantitative analysis of nine MM 302 Da PAHs (∑MM302Da) showed that these compounds accounted for roughly 0.66–4.1% of the total mass for 50 PAHs. The previously unidentified isomers were recurring but generally minor contributors to the ∑MM302Da burden, with N21jF representing 8–14%, DBalF typically 6–10% (but 23% in SRM 2975), and DBajF varying between 1 and 5%. These results demonstrate both the ubiquity and compositional variability of MM 302 Da PAHs in combustion-derived particulate matter and provide new reference data for analytical investigations of MM 302 Da PAHs.

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author
; ; ; and
organization
publishing date
type
Contribution to journal
publication status
epub
subject
keywords
Combustion-related particulate matter, Gas chromatography (GC), Mass spectrometry (MS), MM 302 Da PAH, Polycyclic aromatic hydrocarbons (PAHs), Standard Reference Materials (SRMs)
in
Analytical and Bioanalytical Chemistry
publisher
Springer Science and Business Media B.V.
external identifiers
  • pmid:41979650
  • scopus:105035773986
ISSN
1618-2642
DOI
10.1007/s00216-026-06479-1
language
English
LU publication?
yes
id
959fa175-c7f9-45c5-ae9b-d6a4b396c9c0
date added to LUP
2026-05-29 10:37:23
date last changed
2026-06-12 12:08:34
@article{959fa175-c7f9-45c5-ae9b-d6a4b396c9c0,
  abstract     = {{<p>Polycyclic aromatic hydrocarbons (PAHs) of molecular mass (MM) 302 Da comprise numerous structural isomers that are of high concern for human health. Because of their multiplicity, low abundance in the environment, and limited availability of authentic standards, their occurrence, composition, and environmental health risk remain not well characterized. Here we extend the characterization of MM 302 Da PAH isomers in combustion-related particulate matter with the addition of four newly synthesized and previously unidentified MM 302 Da isomers: dibenzo[a,l]fluoranthene (DBalF), dibenzo[b,l]fluoranthene (DBblF), dibenzo[a,j]fluoranthene (DBajF), and naphtho[2,1-j]fluoranthene (N21jF). Using a coupled high-performance liquid chromatography/gas chromatography-mass spectrometric system with a 50% phenyl methylpolysiloxane stationary phase, 24 MM 302 Da isomers were annotated in four Standard Reference Materials, SRM 1648a, SRM 1649b, SRM 1650b, and SRM 2975, and in four combustion-related particulate matter samples consisting of two traffic-impacted filters and two laboratory-generated combustion samples. Three of the four previously unidentified compounds, DBalF, DBajF, and N21jF, were chromatographically resolved and quantified for the first time in these samples. Quantitative analysis of nine MM 302 Da PAHs (∑MM302Da) showed that these compounds accounted for roughly 0.66–4.1% of the total mass for 50 PAHs. The previously unidentified isomers were recurring but generally minor contributors to the ∑MM302Da burden, with N21jF representing 8–14%, DBalF typically 6–10% (but 23% in SRM 2975), and DBajF varying between 1 and 5%. These results demonstrate both the ubiquity and compositional variability of MM 302 Da PAHs in combustion-derived particulate matter and provide new reference data for analytical investigations of MM 302 Da PAHs.</p>}},
  author       = {{Sadiktsis, Ioannis and Malmborg, Vilhelm B. and Campiglia, Andres D. and Uribe-Romo, Fernando J. and Wise, Stephen A.}},
  issn         = {{1618-2642}},
  keywords     = {{Combustion-related particulate matter; Gas chromatography (GC); Mass spectrometry (MS); MM 302 Da PAH; Polycyclic aromatic hydrocarbons (PAHs); Standard Reference Materials (SRMs)}},
  language     = {{eng}},
  publisher    = {{Springer Science and Business Media B.V.}},
  series       = {{Analytical and Bioanalytical Chemistry}},
  title        = {{Determination of three previously unidentified polycyclic aromatic hydrocarbons of molecular mass 302 Da in particulate Standard Reference Materials (SRMs) and combustion-related samples}},
  url          = {{http://dx.doi.org/10.1007/s00216-026-06479-1}},
  doi          = {{10.1007/s00216-026-06479-1}},
  year         = {{2026}},
}