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Metabolomics: High quality curated HRAM MSn spectral libraries and real time library search for the confident annotation of metabolites

 

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Metabolomics of tea n MS High quality curated HRAM spectral libraries and real time library search for the confident annotation of flavonoids in tea Rahul Deshpande1, Bashar Amer1, Daniel Hermanson1, Brandon Bills1, Reza Jafari2, Pedram Rafeie2, Susan Bird1, Elizabeth Crawford3…
Key words
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High quality curated HRAM annotation of metabolites n MS spectral libraries and real time library search for the confident Rahul Deshpande1, Bashar Amer1, Daniel Hermanson1, Brandon Bills1, Eric Tague1, Susan Bird1, Reza Jafari2, Pedram Rafeie2 and Andreas Hühmer1 1Thermo Fisher…
Key words
rtls, rtlsflavonoid, flavonoidlibrary, libraryflavonoids, flavonoidsspectral, spectralxtm, xtmannotation, annotationinbuilt, inbuilttemplate, templateconfident, confidentcurated, curatedputative, putativetribrid, tribriddata, datamsn
Real time library search for the confident annotation of metabolites on Thermo Ascend Tribrid instrument Rahul Deshpande1, Bashar Amer1, Jingjing Huang1, David Bergen1, Susan Bird1, and Thomas Moehring2, 1Thermo Fisher Scientific, San Jose, USA, 2Thermo Fisher Scientific, Bremen, Germany ABSTRACT…
Key words
rtls, rtlslibrary, libraryflavonoids, flavonoidsspectral, spectralascend, ascendputative, putativeannotation, annotationflavonoid, flavonoidtribrid, tribridmsn, msntea, teaconfident, confidentannotate, annotaterelevant, relevantsearch
APPLICATION NOTE 65363 Novel structure-based profiling and annotation workflow—high-throughput analysis of flavonoids using the Thermo Scientific Orbitrap ID-X Tribrid MS Authors Reiko Kiyonami1, Iwao Sakane2, Seema Sharma1, Graeme McAlister1, Caroline Ding1 and Andreas Huhmer1 Thermo Fisher Scientific, ITO EN, LTD,…
Key words
flavonoid, flavonoidstructure, structuretree, treespectral, spectralcentroids, centroidsfragment, fragmentunknown, unknownmsn, msnannotation, annotationlibrary, librarymatch, matchcompound, compoundmzcloud, mzcloudblazer, blazerflavonoids
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