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NIST 08 PDF Print E-mail

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NIST/EPA/NIH Mass Spectral Library with Search Program: (Data Version: NIST 08, Software Version 2.0f)

The NIST 08 Library of Mass Spectral Data and Search Program comes on one CD ROM, complete with installation program and full document set.  During installation, you are presented with the option to allow the NIST to replace the built in "PBM" searching routine as the default search engine.  If selected, once inside the HP/Agilent Chemstation and you click on the TIC and Spectra - the program is automatically launched, your selected spectra is loaded and the suspected "hits" are presented to you, as well as MUCH MORE information.  All at your finger tips.  Once you try the NIST 08, you will never go back.

For those who prefer to have the Chemstation "PBM" search routine as the default, or have a need for Chemstation to produce the library search report automatically, at the end of each acquisition, we also offer the NIST 08 Library in "HP" Format.  This a separate product, and includes the improved and enlarged NIST 08 Database ONLY.  Please specify if you want this product.
  Contact CSS Analytical for a formal quotation....

Contents of the NIST/EPA/NIH (NIST 08) Mass Spectral Library

Library Name

Library Description

Library Contents

mainlib

Main EI MS library

191,436 spectra

replib

Replicate spectra

28,307 spectra

nist_salts

EI Salt Library

717 spectra

nist_msms

MS/MS Library

14,802 spectra of 3,898 positive and 1,410 negative ions

nist_ri

Retention Index Library

293,247 Kovats RI values for 44,008 compounds



Evaluation and Quality Control

  • Each spectrum critically examined by experienced mass spectrometrists.
  • Each chemical structure examined for correctness and consistency, using both human and computer methods.
  • Spectra of all stereoisomers intercompared.
  • Chemical names examined by experts and IUPAC names provided.
  • Thousands of replacements of spectra with a higher quality spectra.
  • Verified CAS registry numbers.

This library is available with Version 2.0f of the full-featured NIST MS Search Program for Windows, which also includes integrated tools for:

  • GC/MS deconvolution (AMDIS version 2.65)
  • Interpretation of mass spectra (MS Interpreter version 2.0, a thermodynamics-based interpreter of fragmentation)
  • Chemical Substructure Identification

    New features of the NIST MS Search Program are:
  • A spectrum search for MS/MS spectra in MS/MS libraries
  • A search for information in the Contributor/Comment field which may be particularly useful for certain types of information relevant to MS/MS spectra
  • Five new constraints that permit additional types searches
  • Flexibility in using Name fragments in Constraints that allows specifying the presence or absence of arbitrary parts of a name

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Contact CSS Analytical for a formal quotation....



 
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