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