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 |
EQ363552 |
2 |
86 |
0.0811 |
261 |
999 |
H2O |
HNO2S |
C9H12O4 |
C3H6O |
|
C12H21NO8S |
18.0106 |
78.9728 |
184.0736 |
58.0420 |
|
Topiramate |
5514 |
30 |
EQ363552 |
3 |
78 |
0.0916 |
113 |
999 |
H2O |
HNO2S |
C12H18O5 |
|
|
C12H21NO8S |
18.0106 |
78.9728 |
242.1156 |
|
|
Topiramate |
5514 |
30 |
EQ363552 |
4 |
67 |
0.0916 |
106 |
999 |
C3H6O |
HNO2S |
C9H14O5 |
|
|
C12H21NO8S |
58.0420 |
78.9728 |
202.0842 |
|
|
Topiramate |
5514 |
30 |
EQ363552 |
5 |
32 |
0.0915 |
22 |
999 |
C3H6O |
H3NO3S |
C9H12O4 |
|
|
C12H21NO8S |
58.0420 |
96.9834 |
184.0736 |
|
|
Topiramate |
5514 |
30 |
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