mzLogic Data Analysis Algorithm - Accelerate small-molecule unknown identification

TECHNICAL NOTE No. 65602 Building curated and annotated HRAM MSn spectral libraries to aid in unknown structure elucidation Authors: Caroline Ding, Kate Comstock, Seema Sharma, Mark Sanders, Michal Raab Thermo Fisher Scientific, San Jose, CA Keywords: Orbitrap ID-X, Mass Frontier,…

Improved Ranking of Putative Candidates Through a Hybrid In Silico / Real Fragmentation Technique Tim Stratton1, Michal Raab2, Jakub Mezey2, Ioanna Ntai1, Ralf Tautenhahn1, Robert Mistrik2 1Thermo Fisher Scientific, Austin TX, USA; 2HighChem LLC, Bratislava, Slovakia ABSTRACT RESULTS Purpose: To…

Powering confident insights Explore your small-molecule data to its core Thermo Scientific Mass Frontier Software Simplify deep exploration of your small-molecule data and capture structural insights N O HN O Interpretation and characterization of mass-spectral data can be an enormous…

SMALL-MOLECULE MASS SPECTROMETRY Compound Discoverer Software Smart Note The ultimate toolset for transforming small-molecule MS data into meaningful insights My small-molecule MS datasets are incredibly complex, making it challenging to determine what’s in my samples, in what amounts, and most…