[GENERAL]
AmountOfChains=3
ChainLibrary=fattyAcidChains.xlsx
CAtomsFromName=\D*(\d+):\d+
DoubleBondsFromName=\D*\d+:(\d+)
BasePeakCutoff=0.01%
SpectrumCoverage=2%
ChainCutoff=20%
ValidOnlyWithOtherAdduct=NH4
OtherAdductValidityTolerance=0.3
RetentionTimePostprocessing=false


[HEAD]
!FRAGMENTS
Name=Precursor		Formula=$PRECURSOR	Charge=1	MSLevel=2	mandatory=true
Name=PChead_184		Formula=C5H15NO4P	Charge=1	MSLevel=2	mandatory=other

!INTENSITIES
Equation=Precursor>$BASEPEAK*0.7	mandatory=true
Equation=PChead_184<Precursor*0.1	mandatory=true


[CHAINS]
!FRAGMENTS
Name=NL_Carboxy		Formula=$PRECURSOR-$CHAIN	Charge=1	MSLevel=2	mandatory=true
Name=NL_Carboxy_Na	Formula=$PRECURSOR-$CHAIN+H-Na	Charge=1	MSLevel=2	mandatory=true

!INTENSITIES
Equation=NL_Carboxy+NL_Carboxy_Na>$BASEPEAK*0.005			mandatory=true




