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
LU050406 2 72 0.0813 625 0 C5H4 C2H2 C3H2 CH5N C11H13N 64.0312 26.0156 38.0157 31.0421  Pargyline 4688 90
LU050406 3 63 0.0584 445 0 CH5N C3H2 C7H6 C11H13N 31.0421 38.0157 90.0470  Pargyline 4688 90
LU050406 4 53 0.0835 328 0 C2H2 C5H4 C4H7N C11H13N 26.0156 64.0312 69.0578  Pargyline 4688 90
LU050406 5 39 0.1085 273 0 CH5N C5H4 C5H4 C11H13N 31.0421 64.0312 64.0312  Pargyline 4688 90
LU050406 6 34 0.1063 473 0 C5H4 C2H2 C2H3N C2H4 C11H13N 64.0312 26.0156 41.0264 28.0314  Pargyline 4688 90