RECETOX reference spectrum of mass spectra
The RECETOX Mass Spectrum Reference Libraries is a collection of MS spectra collected from authentic compounds. Each library comprises the spectra in MSP format and an accompanying SDF database of compounds. The collection is shared under terms & conditions of CC-BY-NC.
The RECETOX Exposome HR-[EI+]-MS library is a collection of mostly anthropogenic compounds. Spectra were acquired at 70 eV on Thermo Fisher Q Exactive™ GC Orbitrap™ GC-MS/MS at 60000 resolving power. Archived at: 10.5281/zenodo.4471217.
RECETOX GC EI Orbitrap Compounds 20201028
HR-[EI+]-MS compound database
|.sdf 1 MB|
RECETOX GC EI Orbitrap Spectra 20201028
HR-[EI+]-MS spectral library
|.msp 1 MB|