skip to main content
US FlagAn official website of the United States government
dot gov icon
Official websites use .gov
A .gov website belongs to an official government organization in the United States.
https lock icon
Secure .gov websites use HTTPS
A lock ( lock ) or https:// means you've safely connected to the .gov website. Share sensitive information only on official, secure websites.


Search for: All records

Creators/Authors contains: "Faust, Jennifer"

Note: When clicking on a Digital Object Identifier (DOI) number, you will be taken to an external site maintained by the publisher. Some full text articles may not yet be available without a charge during the embargo (administrative interval).
What is a DOI Number?

Some links on this page may take you to non-federal websites. Their policies may differ from this site.

  1. Contaminants released into the atmosphere that undergo regional and long-range transport can deposit back to Earth through snowfall. When snow melts, these contaminants re-enter the environment, sometimes far from their original emission sources. Here we present the first comprehensive characterization of organic contaminants in snow from North America. Fresh snowfall samples were collected in the central United States over a three-year period and measured by liquid chromatography high-resolution mass spectrometry for suspect screening and non-targeted analysis. The resulting data set was screened against experimental MS/MS libraries and underwent supplemental in silico MS/MS analysis. In total, 91 possible compounds were tentatively identified in snow, and 17 were successfully confirmed and semi-quantified with reference standards. These contaminants were mostly anthropogenic in origin and included six herbicides, three insect repellants, one insecticide metabolite, and one fungicide. The most prominent compounds present in all samples were N-cyclohexylformamide (known contaminant in tire leachate), DEET (insect repellent), and dimethyl phthalate (plasticizer), with median deposition fluxes of 4032, 284, and 262 ng m-2, respectively. Three additional compounds were detected in 100% of samples: coumarin (phytochemical and fragrance additive), 5-methylbenzotriazole (antifreeze component), and quinoline (heterocyclic aromatic). The Peto-Peto test revealed statistically significant differences in deposition fluxes for these six contaminants (p < 0.05), with weak but statistically significant positive associations between coumarin and DEET and between coumarin and quinoline according to a Kendall’s tau correlation analysis. These findings demonstrate the utility of in silico analysis to complement MS/MS matching with experimental databases. Even so, thousands of unidentified features remained in the data set, highlighting the limitations of current strategies in non-targeted analysis of environmental samples. 
    more » « less
    Free, publicly-accessible full text available February 1, 2026
  2. Fenpyrazamine (FPA) is a widely used fungicide in agriculture to control fungal diseases, but its environmental degradation by oxidants and the formation of potential degradation products remain unexplored. This study investigates the oxidation of FPA by hydroxyl radicals (HO˙) using density functional theory (DFT) calculations at the M06-2X/6-311++G(3df,3pd)//M06-2X/6-31+G(d,p) level of theory. Three standard oxidation mechanisms, including formal hydrogen transfer (FHT), radical adduct formation (RAF), and single electron transfer (SET), were evaluated in the aqueous phase, with reaction kinetics analyzed over a temperature range of 283–333 K. As a result, the reactivity order of the mechanisms was determined to be RAF > FHT > SET. At 298 K, the calculated total rate constants for FHT and RAF reactions were competitive, being 6.09 × 109 and 8.21 × 109 M−1 s−1, respectively, while that for SET was slightly lower at 2.35 × 109 M−1 s−1. The overall rate constant was estimated to be 1.67 × 1010 M−1 s−1. The most favourable RAF reaction occurred at the C38[double bond, length as m-dash]C39 double bond, while the predominant FHT reactions involved the H15 and H13 hydrogen atoms of the methyl C8 group. The lifetime of FPA in natural water with respect to HO˙ oxidation was predicted to range from 10.84 hours to 2.62 years, depending on environmental conditions. Furthermore, the toxicity assessments revealed that while FPA is neither bioaccumulative nor mutagenic, it poses developmental toxicity and is harmful to aquatic organisms, including fish, daphnia, and green algae. 
    more » « less
    Free, publicly-accessible full text available January 22, 2026