Big Free-Access Chemical Databases in Non-Target Mass Spectrometry Analysis

The ChemSpider and PubChem chemical databases used in non-target mass spectrometry analysis in order to outline the candidates for identification are described. Relevant compounds are searched by molecule-containing ion masses (only ChemSpider) or by molecular formulas before determined (both databa...

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Veröffentlicht in:	Journal of analytical chemistry (New York, N.Y.) N.Y.), 2021-12, Vol.76 (13), p.1477-1484
Hauptverfasser:	Milman, B. L., Ostrovidova, E. V., Zhurkovich, I. K.
Format:	Artikel
Sprache:	eng
Schlagworte:	Analytical Chemistry Chemical compounds Chemistry Chemistry and Materials Science Ions Mass spectra Mass spectrometry Reference materials Scientific imaging Spectroscopy
Online-Zugang:	Volltext
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