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

LU119505

2

38

0.1378

353

34

C3H6

C3H6

C3H9N

C3H6

C12H27N

42.0468

42.0468

59.0734

42.0468

Dodecylamine

13583

75

LU119505

3

30

0.1253

226

34

C3H6

C3H9N

C6H12

C12H27N

42.0468

59.0734

84.0938

Dodecylamine

13583

75