Analyte |
RRT in LC MS |
MS-ES or
MS-MS |
m/z value |
Measured Mass |
Best possible molecular formulae |
Exact Mass |
PPM error |
AMD-Imp |
0.53 |
MS-ES |
157.0247 |
156.0247 |
C7H8O2S |
156.0245 |
-1.28 |
|
|
|
125.0346 |
124.0346 |
C7H8S |
124.0347 |
0.81 |
AMD |
1.00 |
MS-ES |
296.0721 |
273.0823 |
C15H15NO2S |
273.0823 |
0.00 |
|
|
|
297.0710 |
273.0812 |
C15H15NO2S |
273.0823 |
4.03 |
|
|
|
274.0828 |
273.0828 |
C15H15NO2S |
273.0823 |
-1.83 |
|
|
|
167.0843 |
167.0843 |
C13H11+ |
167.0855 |
7.18 |
|
|
|
168.0848 |
167.0848 |
C13H11+ |
167.0855 |
4.19 |
|
1.00 |
MS-MS |
296.0711 |
273.0813 |
C15H15NO2S |
273.0823 |
3.66 |
|
|
|
167.0856 |
167.0856 |
C13H11+ |
167.0855 |
-0.60 |
|
|
|
168.0858 |
167.0858 |
C13H11+ |
167.0855 |
-1.80 |
|