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Generation of molecular formulas by high-resolution MS and MS/MS data
...The software user manual is available here: https://www.researchgate.net/publication/307964728_MOLGEN-MSMS_Software_User_Manual
Example MS and MS/MS data files for GenForm can be downloaded here: https://sourceforge.net/p/genform/code/HEAD/tree/trunk/data/
A first program call could look like this:
GenForm ms=SinapinicAcidMs.txt msms=SinapinicAcidMsMs.txt exist out