Easily Obtains All the Information Required for Qualitative Analysis

Easily Obtains All the Information Required for Qualitative Analysis

With GC/MS, which has significant qualitative capabilities, a wealth of fragment information is obtained, so it is used as a means of identifying unknown compounds. A mass spectral library is generally used as a means of compound identification. However, experience with compound identification is required if the compound is not registered in the mass spectral library, or there are a number of compounds with similar structures. With the GCMS-QP2020 NX, in addition to the mass spectrum, three kinds of value-added compound information are used in combination to support high-accuracy qualitative analysis.

Databases Containing High Value-Added Retention Indices

Databases are available with retention indices specific to a variety of application fields, including foods, chemistry, fragrances, forensics, and metabolite component analysis. In addition to mass spectra, searches are performed in combination with retention indices, which are very highly compound specific, so isomers and compounds with similar structures are accurately identified.

Other Mass Spectra Libraries

  • NIST Mass Spectral Library
    Registered with approx. 306,622 spectra.
  • WILEY Mass Spectral Library
    Registered with approx. 775,500 spectra.
  • GC/MS MPW DRUG Library
    Drugs, toxicants, pesticides, environmental pollutants
    (approx. 10,430 compounds)

Up to 10 library files can be configured. In addition to the public NIST and Wiley libraries, a variety of library files can be configured. In addition, there is a function to easily create private libraries.

Smart EI/CI Ion Source Easily Switches Between EI and CI Methods

The Smart EI/CI ion source has been developed in order to acquire CI data without switching the ion source, and without losing the sensitivity of EI, which is most commonly used. Even when it is difficult to perform identification with the EI mode using the mass spectral library, molecular weight information can be obtained from CI data, thus helping in the estimation of unknown compounds.

Estimating Composition Using Accurate Mass

The MassWorks software calculates the theoretical accurate mass from the quadrupole MS mass profile. It then outputs candidate compositional formulas based on isotopic ratios and the theoretical accurate mass. This software is useful for estimating the composition of compounds that are not registered in a mass spectral library. The GCMSsolutionâ„¢ software can simultaneously output GC/MS data and mass profile data. The majority of compounds detected with the GC/MS data can be identified from a mass spectral library. MassWorks is then used to estimate the composition of any compounds that are not identified, further increasing the quality of the qualitative analysis.

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