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GNPS - Beer pHILIC LC-MS/MS and LC-MS data - used for MS2LDA substructure discovery

ABSTRACT: Beer samples measured using pHILIC LC-MS/MS and LC-MS in positive and negative ionisation mode. Beers were samples from various types and locations - mainly including pale ales and Indian Pale Ales (IPAs). Samples were used for MS2LDA substructure discovery to find the building blocks of metabolomics.

INSTRUMENT(S): Q Exactive

ORGANISM(S): Hordeum Vulgare Subsp. Vulgare (ncbitaxon:112509) Saccharomyces Cerevisiae (ncbitaxon:4932) Humulus Lupulus (ncbitaxon:3486)

SUBMITTER: Justin van der Hooft

PROVIDER: MSV000081119 | GNPS | Mon May 29 03:20:00 BST 2017

REPOSITORIES: GNPS

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