Diagnostic Fragmentation Pathways for Identification of Phthalate Metabolites in Nontargeted Analysis Studies
Prioritized candidate molecular ions in the pooled urine spiking Level-0 (Table S1) prioritized candidate molecular ions in the pooled urine spiking Level-I (Table S2), prioritized candidate molecular ions in the pooled urine spiking Level-II (Table S3), and TIC and EICs of m/z 121.0295 from the DIA data of the pooled urine sample spiked with 100 ppb of 24 metabolite standards at a collision energy of 0, 10, 20, and 40 V, respectively (Figure S1)
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Supplementary Tables - Diagnostic Fragmentation Pathways_revised-clean.xlsx
APPLICATION/VND.OPENXMLFORMATS-OFFICEDOCUMENT.SPREADSHEETML.SHEET -
Table 1 - summary of common fragments.xlsx
APPLICATION/VND.OPENXMLFORMATS-OFFICEDOCUMENT.SPREADSHEETML.SHEET -
js2c00052_si_001.pdf
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Complete Metadata
| @type | dcat:Dataset |
|---|---|
| accessLevel | public |
| bureauCode |
[ "020:00" ] |
| contactPoint |
{ "fn": "Alex Chao", "hasEmail": "mailto:chao.alex@epa.gov" } |
| description | Prioritized candidate molecular ions in the pooled urine spiking Level-0 (Table S1) prioritized candidate molecular ions in the pooled urine spiking Level-I (Table S2), prioritized candidate molecular ions in the pooled urine spiking Level-II (Table S3), and TIC and EICs of m/z 121.0295 from the DIA data of the pooled urine sample spiked with 100 ppb of 24 metabolite standards at a collision energy of 0, 10, 20, and 40 V, respectively (Figure S1) |
| distribution |
[ { "title": "Supplementary Tables - Diagnostic Fragmentation Pathways_revised-clean.xlsx", "mediaType": "application/vnd.openxmlformats-officedocument.spreadsheetml.sheet", "downloadURL": "https://pasteur.epa.gov/uploads/10.23719/1527686/Supplementary%20Tables%20-%20Diagnostic%20Fragmentation%20Pathways_revised-clean.xlsx" }, { "title": "Table 1 - summary of common fragments.xlsx", "mediaType": "application/vnd.openxmlformats-officedocument.spreadsheetml.sheet", "downloadURL": "https://pasteur.epa.gov/uploads/10.23719/1527686/Table%201%20-%20summary%20of%20common%20fragments.xlsx" }, { "title": "js2c00052_si_001.pdf", "mediaType": "application/pdf", "downloadURL": "https://pasteur.epa.gov/uploads/10.23719/1527686/js2c00052_si_001.pdf" } ] |
| identifier | https://doi.org/10.23719/1527686 |
| keyword |
[ "Phthalate metabolites", "environmental health", "exposome and exposomics", "mass spectrometry", "non-targeted analysis" ] |
| license | https://pasteur.epa.gov/license/sciencehub-license-non-epa-generated.html |
| modified | 2022-05-09 |
| programCode |
[ "020:000" ] |
| publisher |
{ "name": "U.S. EPA Office of Research and Development (ORD)", "subOrganizationOf": { "name": "U.S. Environmental Protection Agency", "subOrganizationOf": { "name": "U.S. Government" } } } |
| references |
null
|
| rights |
null
|
| title | Diagnostic Fragmentation Pathways for Identification of Phthalate Metabolites in Nontargeted Analysis Studies |
