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Customized Metabolomics Database for the Analysis of NMR (1)H–(1)H TOCSY and (13)C–(1)H HSQC-TOCSY Spectra of Complex Mixtures

[Image: see text] A customized metabolomics NMR database, termed (1)H((13)C)-TOCCATA, is introduced, which contains complete (1)H and (13)C chemical shift information on individual spin systems and isomeric states of common metabolites. Since this information directly corresponds to cross sections o...

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Detalles Bibliográficos
Autores principales:	Bingol, Kerem, Bruschweiler-Li, Lei, Li, Da-Wei, Brüschweiler, Rafael
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2014
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4051244/ https://www.ncbi.nlm.nih.gov/pubmed/24773139 http://dx.doi.org/10.1021/ac500979g

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