Creating a Reliable Mass Spectral–Retention Time Library for All Ion Fragmentation-Based Metabolomics

Creating a Reliable Mass Spectral–Retention Time Library for All Ion Fragmentation-Based Metabolomics

Accurate metabolite identification remains one of the primary challenges in a metabolomics study. A reliable chemical spectral library increases the confidence in annotation, and the availability of raw and annotated data in public databases facilitates the transfer of Liquid chromatography coupled...

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Bibliographic Details
Main Authors: Ipputa Tada, Hiroshi Tsugawa, Isabel Meister, Pei Zhang, Rie Shu, Riho Katsumi, Craig E. Wheelock, Masanori Arita, Romanas Chaleckis
Format: Article
Language:English
Published: MDPI AG 2019-10-01
Series:Metabolites
Subjects:
lc–ms
metabolomics
mass spectral deconvolution
chemical library
all ion fragmentation
Online Access:https://www.mdpi.com/2218-1989/9/11/251

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https://www.mdpi.com/2218-1989/9/11/251

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