Downloading Reference Spectral Libraries
Downloading GNPS Spectral Libraries¶
Download GNPS Spectral libraries on each of the spectral library pages.
Click the download icon to get an MGF version of the spectral library.
With a full list that can be found here.
MGF Format for GNPS Library Spectrum
``` BEGIN IONS PEPMASS=561.365 CHARGE=1 MSLEVEL=2 SOURCE_INSTRUMENT=DI-ESI-LTQ-FT-ICR FILENAME=Desferrioxamine_B_1H_561_3647.mzXML SEQ=.. IONMODE=Positive ORGANISM=GNPS-LIBRARY NAME=Desferrioxamine B M+H PI=Dorrestein DATACOLLECTOR=J Watrous SMILES=N/A INCHI=N/A INCHIAUX=N/A PUBMED=N/A SUBMITUSER=jdwatrou TAGS= LIBRARYQUALITY=3 SPECTRUMID=CCMSLIB00000072100 SCANS=1 161.0 2.216415 161.27272 3.386504 165.181824 94.756683 166.272736 38.394264 167.0 0.407026 168.363632 4.767616 169.272736 1.753857 170.363632 3.976861 171.181824 1.136681 172.181824 0.95803 175.090912 0.973687 177.363632 0.904491 181.181824 0.374121 181.454544 1.961724 182.363632 1.306631 183.272736 162.821075 184.272736 3.942838 185.272736 7.338296 186.363632 1.208049 190.181824 1.380652 190.545456 0.753061 191.0 0.477648 END IONS
```
License¶
All GNPS Reference spectra contributed directly to GNPS by default will have the CC0 license.
Third party libraries imported may not conform to the CC BY license and should be verified by users.
Page Contributions¶