[GENERAL]
AmountOfChains=1
ChainLibrary=fattyAcidChains.xlsx
CAtomsFromName=\D*(\d+):\d+
DoubleBondsFromName=\D*\d+:(\d+)
BasePeakCutoff=0.1%
ChainCutoff=1%
SpectrumCoverage=10%
RetentionTimePostprocessing=true


[HEAD]
!FRAGMENTS
Name=LCB 18:1;2(-C2H8NO)	Formula=C16H29O			Charge=1	MSLevel=2	mandatory=false
Name=Cer(254)			Formula=C18H31O			Charge=1	MSLevel=2	mandatory=false
Name=-Cer(18)			Formula=$PRECURSOR-H2O		Charge=1	MSLevel=2	mandatory=false
Name=-Cer(30)			Formula=$PRECURSOR-CH2O		Charge=1	MSLevel=2	mandatory=true
Name=-Cer(32)			Formula=$PRECURSOR-CH4O		Charge=1	MSLevel=2	mandatory=false
Name=-Cer(48)			Formula=$PRECURSOR-CH4O2	Charge=1	MSLevel=2	mandatory=false
Name=-Cer(240)			Formula=$PRECURSOR-C16H32O	Charge=1	MSLevel=2	mandatory=false
Name=-Cer(256)			Formula=$PRECURSOR-C16H32O2	Charge=1	MSLevel=2	mandatory=true
Name=-Cer(282)			Formula=$PRECURSOR-C18H34O2	Charge=1	MSLevel=2	mandatory=false
Name=-Cer(46)			Formula=$PRECURSOR-CH2O2	Charge=1	MSLevel=2	mandatory=other
Name=Precursor			Formula=$PRECURSOR		Charge=1	MSLevel=2	mandatory=other

!INTENSITIES
Equation=-Cer(256)>Precursor				mandatory=true
Equation=-Cer(46)<-Cer(256)*0.8		mandatory=true


[CHAINS]
!FRAGMENTS
Name=FA (+O)	Formula=$CHAIN-H	Charge=1	MSLevel=2	mandatory=true
Name=FA (-H2)	Formula=$CHAIN-H3O	Charge=1	MSLevel=2	mandatory=false
