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Department of Chemistry

Mass Spectrometry Related Links

Tools and Databases (selection)

 
Envipat, an exact mass and isotopic distribution calculator from the EAWAG

ChemSpider, a collection of NMR, MS and IR spectra

MassBank, a high quality mass spectral database

HMDB, the human metabolom database

mzCloud, MS/MS spectral library

Venoms, our own collection of MS spectra of small molecules found in spider venom

Websites

 
mzMine, mass spectrometry services

Sirius and Canopus, analysing of LC-MS/MS data from biological interest

GNPS, molecular networking and annotation of LC-MS/MS data

Skyline, a freeware data processing software