Data provided by National Institute of Standards and Technology
Liquid-chromatography-mass spectrometry (LC-MS) raw data sets from various instruments delivered in their native instrument format. 31 files in all. 7.5 GB data.
About this Dataset
Updated: 2026-08-20
Metadata Last Updated:
2016-05-20 00:00:00
Date Created:
N/A
Data Provided by:
Dataset Owner:
N/A
| Title | Raw data files that were used in writing "Analysis of human plasma metabolites across different liquid chromatography/mass spectrometry platforms: Cross-platform transferable chemical signatures" by Kelly H. Telu, Xinjian Yan, William E. Wallace, Stephen E. Stein and Yamil Simón-Manso, Published paper: DOI: 10.1002/rcm.7475 |
|---|---|
| Description | Liquid-chromatography-mass spectrometry (LC-MS) raw data sets from various instruments delivered in their native instrument format. 31 files in all. 7.5 GB data. |
| Modified | 2016-05-20 00:00:00 |
| Publisher Name | National Institute of Standards and Technology |
| Contact | mailto:[email protected] |
| Keywords | human blood plasma , metabolomics , mass spectrometry , liquid chromatography , SRM 1950 |
{
"identifier": "333921C30B07D332E0531A5706812AD51458",
"accessLevel": "public",
"contactPoint": {
"hasEmail": "mailto:[email protected]",
"fn": "William E. Wallace III"
},
"programCode": [
"006:045"
],
"landingPage": "http:\/\/chmdatafnx.chemref-838.nist.gov\/dokuwiki\/doku.php?id=chemdata:srm1950raw",
"title": "Raw data files that were used in writing \"Analysis of human plasma metabolites across different liquid chromatography\/mass spectrometry platforms: Cross-platform transferable chemical signatures\" by Kelly H. Telu, Xinjian Yan, William E. Wallace, Stephen E. Stein and Yamil Sim\u00f3n-Manso, Published paper: DOI: 10.1002\/rcm.7475",
"description": "Liquid-chromatography-mass spectrometry (LC-MS) raw data sets from various instruments delivered in their native instrument format. 31 files in all. 7.5 GB data.",
"language": [
"en"
],
"distribution": [
{
"accessURL": "https:\/\/dx.doi.org\/10.18434\/T4K88D",
"format": "Agilent Technologies and Thermo Scientific raw data files",
"description": "Analysis of NIST Standard Reference Material 1950 across several LC\/MS platforms following the same sample preparation procedures. These included different liquid chromatography separations (conventional HPLC, UHPLC and nanoLC) and different mass spectrometers (Q-TOF and Orbitrap).",
"title": "Raw LC-MS\/MS Data of Standard Reference Material 1950, Metabolites in Human Plasma"
},
{
"accessURL": "http:\/\/chemdata.nist.gov\/dokuwiki\/doku.php?id=chemdata:srm1950raw",
"format": "Agilent Technologies and Thermo Scientific raw data files",
"description": "Analysis of SRM 1950 across several LC\/MS platforms ? following the same sample preparation procedures. These included different liquid chromatography separations (conventional HPLC, UHPLC and nanoLC) and different mass spectrometers (Q-TOF and Orbitrap).",
"mediaType": "text\/html",
"title": "Raw LC-MS\/MS Data of Standard Reference Material 1950, Metabolites in Human Plasma"
},
{
"downloadURL": "https:\/\/opendata.nist.gov\/1458_Telu_human_plasma_metabolites.zip",
"format": "Agilent Technologies and Thermo Scientific raw data files",
"description": "Analysis of NIST Standard Reference Material 1950 across several LC\/MS platforms following the same sample preparation procedures. These included different liquid chromatography separations (conventional HPLC, UHPLC and nanoLC) and different mass spectrometers (Q-TOF and Orbitrap).",
"mediaType": "application\/zip",
"title": "Zipped file of Telu human plasma metabolites data"
},
{
"downloadURL": "https:\/\/opendata.nist.gov\/1458_Telu_human_plasma_metabolites.zip.sha256",
"format": "SHA-256 hash of zipped data file",
"description": "SHA-256 hash for verification of zipped data",
"mediaType": "text\/plain",
"title": "SHA-256 hash of zipped data for Telu human plasma metabolites"
},
{
"accessURL": "https:\/\/doi.org\/10.18434\/t4k88d",
"description": "DOI access to Raw data files that were used in writing \"Analysis of human plasma metabolites across different liquid chromatography\/mass spectrometry platforms: Cross-platform transferable chemical signatures\"",
"title": "DOI Access to Raw data files that were used in writing 'Analysis of human plasma meta...'"
}
],
"bureauCode": [
"006:55"
],
"modified": "2016-05-20 00:00:00",
"publisher": {
"@type": "org:Organization",
"name": "National Institute of Standards and Technology"
},
"theme": [
"Health:Clinical diagnostics",
"Chemistry:Analytical chemistry",
"Standards:Reference materials",
"Chemistry:Molecular characterization"
],
"keyword": [
"human blood plasma",
"metabolomics",
"mass spectrometry",
"liquid chromatography",
"SRM 1950"
]
}