[GENERAL]
AmountOfChains=3
ChainLibrary=fattyAcidChains.xlsx
CAtomsFromName=\D*(\d+):\d+
DoubleBondsFromName=\D*\d+:(\d+)
BasePeakCutoff=0.01%
ChainCutoff=20%
RetentionTimePostprocessing=true


[HEAD]
!FRAGMENTS
Name=Precursor		Formula=$PRECURSOR	Charge=1	MSLevel=2	mandatory=true
Name=NL_NH3		Formula=$PRECURSOR-NH3	Charge=1	MSLevel=2	mandatory=false

!INTENSITIES
Equation=NL_NH3<0.05*$BASEPEAK	mandatory=true


[CHAINS]
!FRAGMENTS
Name=NL_Carboxy		Formula=$PRECURSOR-$CHAIN	Charge=1	MSLevel=2	mandatory=false
Name=NL_Carboxy_Na	Formula=$PRECURSOR-$CHAIN+H-Na	Charge=1	MSLevel=2	mandatory=false
Name=MG_fragment_IS	Formula=$CHAIN+C3D5O		Charge=1	MSLevel=2	mandatory=false
Name=MG_fragment	Formula=$CHAIN+C3H5O		Charge=1	MSLevel=2	mandatory=false


!INTENSITIES
Equation=NL_Carboxy_Na>NL_Carboxy	mandatory=false
