Return to search results
NIST DART-MS Forensics Database (is-CID)
The NIST DART-MS Forensics Database is an evaluated collection of in-source collisionally-induced dissociation (is-CID) mass spectra of compounds of interest to the forensics community (e.g. seized drugs, cutting agents, etc.). The is-CID mass spectra were collected using Direct Analysis in Real-Time (DART) Mass Spectrometry (MS), either by NIST scientists or by contributing agencies noted per compound. The database is provided as a general-purpose structure data file (.SDF). For users on Windows operating systems, the .SDF format library can be converted to NIST MS Search format using Lib2NIST and then explored using NIST MS Search v2.4 for general mass spectral analysis. These software tools can be downloaded at https://chemdata.nist.gov. The database is now (09-28-2021) also provided in R data format (.RDS) for use with the R programming language. This database, also commonly referred to as a library, is one in a series of high-quality mass spectral libraries/databases produced by NIST (see NIST SRD 1a, https://dx.doi.org/10.18434/T4H594).
Resources
6 resources available
-
210915_He_Pos_Library_Dragonfly
APPLICATION/ZIP -
220120_He_Pos_Library_Earthworm
APPLICATION/ZIP -
230104_He_Pos_Library_Grasshopper
APPLICATION/ZIP -
230919_HePos_Hornet_v1
APPLICATION/ZIP -
240319_HePos_Inchworm_v1
APPLICATION/ZIP -
250101_HePos_Joro
APPLICATION/ZIP
Complete Metadata
| @type | dcat:Dataset |
|---|---|
| accessLevel | public |
| accrualPeriodicity | irregular |
| bureauCode |
[
"006:55"
]
|
| contactPoint |
{
"fn": "Edward Sisco",
"hasEmail": "mailto:edward.sisco@nist.gov"
}
|
| description | The NIST DART-MS Forensics Database is an evaluated collection of in-source collisionally-induced dissociation (is-CID) mass spectra of compounds of interest to the forensics community (e.g. seized drugs, cutting agents, etc.). The is-CID mass spectra were collected using Direct Analysis in Real-Time (DART) Mass Spectrometry (MS), either by NIST scientists or by contributing agencies noted per compound. The database is provided as a general-purpose structure data file (.SDF). For users on Windows operating systems, the .SDF format library can be converted to NIST MS Search format using Lib2NIST and then explored using NIST MS Search v2.4 for general mass spectral analysis. These software tools can be downloaded at https://chemdata.nist.gov. The database is now (09-28-2021) also provided in R data format (.RDS) for use with the R programming language. This database, also commonly referred to as a library, is one in a series of high-quality mass spectral libraries/databases produced by NIST (see NIST SRD 1a, https://dx.doi.org/10.18434/T4H594). |
| distribution |
[
{
"title": "210915_He_Pos_Library_Dragonfly",
"mediaType": "application/zip",
"downloadURL": "https://data.nist.gov/od/ds/mds2-2313/210915_He_Pos_Library_Dragonfly.zip"
},
{
"title": "220120_He_Pos_Library_Earthworm",
"mediaType": "application/zip",
"downloadURL": "https://data.nist.gov/od/ds/mds2-2313/220120_He_Pos_Library_Earthworm.zip"
},
{
"title": "230104_He_Pos_Library_Grasshopper",
"mediaType": "application/zip",
"downloadURL": "https://data.nist.gov/od/ds/mds2-2313/230104_He_Pos_Library_Grasshopper.zip"
},
{
"title": "230919_HePos_Hornet_v1",
"mediaType": "application/zip",
"downloadURL": "https://data.nist.gov/od/ds/mds2-2313/230919_HePos_Hornet_v1.zip"
},
{
"title": "240319_HePos_Inchworm_v1",
"mediaType": "application/zip",
"downloadURL": "https://data.nist.gov/od/ds/mds2-2313/240319_HePos_Inchworm_v1.zip"
},
{
"title": "250101_HePos_Joro",
"mediaType": "application/zip",
"downloadURL": "https://data.nist.gov/od/ds/mds2-2313/250101_HePos_Joro.zip"
}
]
|
| identifier | ark:/88434/mds2-2313 |
| keyword |
[
"Biosciences and Health",
"Chemical Identification",
"Ion Fragmentation",
"Mass Spectra",
"Mass Spectrometry",
"NIST Mass Spectral Libraries",
"Security and Forensics",
"Standard Reference Data"
]
|
| landingPage | https://data.nist.gov/od/id/mds2-2313 |
| language |
[
"en"
]
|
| license | https://www.nist.gov/open/license |
| modified | 2020-10-20 00:00:00 |
| programCode |
[
"006:045"
]
|
| publisher |
{
"name": "National Institute of Standards and Technology",
"@type": "org:Organization"
}
|
| replaces | ark:/88434/mds2-2313 |
| theme |
[
"Chemistry:Analytical chemistry"
]
|
| title | NIST DART-MS Forensics Database (is-CID) |
