Some of the isotopic pattern annotations are not conclusive (unless I am misinterpreting the column).
e.g. annotations
M|M+0.3309_1C13 -> means a charge state of 3, but according to mz / neutral mass value of the feature the charge state is 1.
M|M+0.5011_1C13 -> charge state of 2, again feature info in the table says charge state of 1.
Then, there are some weird values in the raw isotope pattern column
e.g. 0.5028|0.1524|1.0000
Just wanted to leave this here FYI (no need to respond).
Hi Alexis,
Some of the isotopic pattern annotations are not conclusive (unless I am misinterpreting the column).
e.g. annotations M|M+0.3309_1C13 -> means a charge state of 3, but according to mz / neutral mass value of the feature the charge state is 1. M|M+0.5011_1C13 -> charge state of 2, again feature info in the table says charge state of 1.
Then, there are some weird values in the raw isotope pattern column e.g. 0.5028|0.1524|1.0000
Just wanted to leave this here FYI (no need to respond).
Cheers, Thomas