LIPIDS Mass Spectral Database

Technique: GC-MS

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Overview

Extensively validated to ensure positive lipid identification

The Lipids Mass Spectral Database contains 430 GC mass spectra registered from a pure standard and categorized into 11 classes of lipids. The database provides significant support for peak assignment in complex mixtures, making it a valuable tool in many research areas such as food analysis and clinical and medical applications.

Over 1,400 Linear Retention Index (LRI) values for the 430 lipid-like molecules, experimentally calculated for each standard under repeatable chromatographic conditions and using three different stationary phases, namely SLB-5ms, Equity-1, and Supelcowax-10 (Supelco). LRI were also calculated using different reference mixtures, namely alkanes, fatty acid methyl esters (FAMEs), and fatty acid ethyl esters (FAEEs). Additional component information such as CAS number, common name, systematic name, nominal mass (as Mol Wt.), compound formula, chemical class, and suppliers of the standards are also included.

Library Specifications

Spectra: 430
Structures: 430
Unique Compounds: 428
LRI Values: > 1,400
Classes of lipids: 11

Compatibility

Agilent ChemStation, MassHunter, OpenLab
Bruker MS Workstation
Chromatec Analytic
JEOL msFineAnalysis
LECO ChromaTOF
NIST MS Search
PerkinElmer TurboMass
Scion MS Workstation
Thermo Chromeleon, TraceFinder, Xcalibur
Waters MassLynx

Other versions available:
ACD/Labs ACD/Spectrus Processor*
Bio-Rad KnowItAll®*
Wiley Spectra Lab*

*Subscription required

A version in the Shimadzu GCMSsolution format is available directly from Shimadzu. 

Compound Coverage

Compound coverage can be searched at www.compoundsearch.com. The number of compounds in each class is listed below:

  • Alkanes: 34
  • Fatty acid ethyl esters: 27
  • Fatty acid methyl esters: 199
  • Fatty acid trimethyl esters: 14
  • Fatty alcohols: 24
  • Fatty aldehydes: 48
  • Isoprenoids: 2
  • Quinones and hydroquinones: 3
  • Sterol trimethylsilyl esters: 12
  • Sterols: 3
  • Wax monoesters: 64