MLchartDataset catalogue

Mass spectral library

Term · Chemistry · MLC-T-CHM-006994

A curated digital collection of mass spectra used for identifying unknown compounds by comparing their experimental spectra against reference data. Each entry in the library contains the mass spectrum of a known compound, along with associated information such as its chemical name, structure, and the instrumental conditions under which the spectrum was acquired. Prominent examples of these databases include the NIST/EPA/NIH Mass Spectral Library and the Wiley Registry of Mass Spectral Data.

Table 1. Record
IdentifierMLC-T-CHM-006994
FieldChemistry
SubjectAnalytical Chemistry
ReferencesPAC, 2013, 85, 1515. 'Definitions of terms relating to mass spectrometry (IUPAC Recommendations 2013)' on page 1565 (https://doi.org/10.1351/PAC-REC-06-04-06)
Record as JSON
{
  "id": "MLC-T-CHM-006994",
  "term": "Mass spectral library",
  "field": "Chemistry",
  "definition": "A curated digital collection of mass spectra used for identifying unknown compounds by comparing their experimental spectra against reference data. Each entry in the library contains the mass spectrum of a known compound, along with associated information such as its chemical name, structure, and the instrumental conditions under which the spectrum was acquired. Prominent examples of these databases include the NIST/EPA/NIH Mass Spectral Library and the Wiley Registry of Mass Spectral Data.",
  "subject": "Analytical Chemistry",
  "references": [
    "PAC, 2013, 85, 1515. 'Definitions of terms relating to mass spectrometry (IUPAC Recommendations 2013)' on page 1565 (https://doi.org/10.1351/PAC-REC-06-04-06)"
  ],
  "url": "https://mlchart.com/terminology/chemistry/mass-spectral-library/"
}

Record 7,410 of 13,676 in Chemistry terminology (MLC-0109). Request the full dataset.