MB spectrum Partition Partition Score  Mass Error Feasibilty % Precursor SF1 SF2 SF3 SF4 SF5 Whole Formula SFmass1 SFmass2 SFmass3 SFmass4 SFmass5 Compound Pubchem CID  CE Small Neutral Loss Neutral Intensity Smallest Fragment Small Frag Intensity over under over intense Under intense dispersion
LU066453 2 72 0.0167 1277 0 H2O C5H8O CO2 C6H10O4 18.0105 84.0575 43.9898 PCID 196 45 43.9898 870 82.04187 381 3 0 225 0 55