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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...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical
Society
2014
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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 |