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 | ||||