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
LU055005 2 72 0.1202 649 0 C5H8 CO C6H8 C7H10 C2H4O C21H30O2 68.0624 27.9948 80.0624 94.0782 44.0262  Progesterone 5994 75
LU055005 3 65 0.1202 649 0 C2H2 CH2O C5H6 C6H6 C7H14O C21H30O2 26.0156 30.0104 66.0468 78.0468 114.1044  Progesterone 5994 75
LU055005 4 63 0.1503 592 0 C3H8O CH2O C5H6 C6H6 C6H8 C21H30O2 60.0574 30.0104 66.0468 78.0468 80.0624  Progesterone 5994 75
LU055005 5 60 0.1503 592 0 C3H8O CO C5H8 C6H8 C6H6 C21H30O2 60.0574 27.9948 68.0624 80.0624 78.0468  Progesterone 5994 75
LU055005 6 58 0.1202 566 0 C7H6 H2O C6H6 C2H2 C6H14O C21H30O2 90.0468 18.0104 78.0468 26.0156 102.1044  Progesterone 5994 75
LU055005 7 58 0.1202 566 0 H2O C6H6 C2H4O C6H8 C7H10 C21H30O2 18.0104 78.0468 44.0262 80.0624 94.0782  Progesterone 5994 75