<?xml version="1.0" encoding="utf-8" ?>
<ExplicitAbstractIons Version="1">
  <AbstractIons Version="1">
    <AbstractIon WeightFactor="99">M+H</AbstractIon>
    <AbstractIon WeightFactor="70">M+Na</AbstractIon>
    <AbstractIon>M+H-H2O</AbstractIon>
    <AbstractIon WeightFactor="60">M+K</AbstractIon>
    <AbstractIon WeightFactor="60">M+NH4</AbstractIon>
    <AbstractIon WeightFactor="60">M+H-NH3</AbstractIon>
    <AbstractIon>2M+H</AbstractIon>
    <AbstractIon>M+ACN+H</AbstractIon>
    <AbstractIon>M+H+MeOH</AbstractIon>
    <AbstractIon>M+DMSO+H</AbstractIon>
    <AbstractIon>M+ACN+Na</AbstractIon>
    <AbstractIon>2M+K</AbstractIon>
    <AbstractIon>2M+Na</AbstractIon>
    <AbstractIon>2M+NH4</AbstractIon>
    <AbstractIon>2M+ACN+H</AbstractIon>
    <AbstractIon>2M+ACN+Na</AbstractIon>
    <AbstractIon>M+2H</AbstractIon>
    <AbstractIon>M+ACN+2H</AbstractIon>
    <AbstractIon>M+H+K</AbstractIon>
    <AbstractIon>M+H+Na</AbstractIon>
    <AbstractIon>M+H+NH4</AbstractIon>
    <AbstractIon>M-H</AbstractIon>
    <AbstractIon>M-H-H2O</AbstractIon>
    <AbstractIon>M+FA-H</AbstractIon>
    <AbstractIon>M-H+HAc</AbstractIon>
    <AbstractIon>M-H+TFA</AbstractIon>
    <AbstractIon>M+Cl</AbstractIon>
    <AbstractIon>M-2H</AbstractIon>
    <AbstractIon>M-2H+K</AbstractIon>
    <AbstractIon>2M+FA-H</AbstractIon>
    <AbstractIon>2M-H+HAc</AbstractIon>
    <AbstractIon>2M-H</AbstractIon>
  </AbstractIons>
  <Adducts Version="1">
    <Adduct>
      <Name>H</Name>
      <ElementalCompositionFormula>H</ElementalCompositionFormula>
      <Charge>1</Charge>
      <ReadOnly>true</ReadOnly>
    </Adduct>
    <Adduct>
      <Name>e</Name>
      <ElementalCompositionFormula></ElementalCompositionFormula>
      <Charge>-1</Charge>
      <ReadOnly>true</ReadOnly>
    </Adduct>
    <Adduct>
      <Name>Na</Name>
      <ElementalCompositionFormula>Na</ElementalCompositionFormula>
      <Charge>1</Charge>
      <ReadOnly>true</ReadOnly>
    </Adduct>
    <Adduct>
      <Name>K</Name>
      <ElementalCompositionFormula>K</ElementalCompositionFormula>
      <ReadOnly>true</ReadOnly>
      <Charge>1</Charge>
      <ReadOnly>true</ReadOnly>
    </Adduct>
    <Adduct>
      <Name>NH4</Name>
      <ElementalCompositionFormula>NH4</ElementalCompositionFormula>
      <Charge>1</Charge>
      <ReadOnly>true</ReadOnly>
    </Adduct>
    <Adduct>
      <Name>Fe</Name>
      <ElementalCompositionFormula>Fe</ElementalCompositionFormula>
      <Charge>3</Charge>
    </Adduct>
    <Adduct>
      <Name>Cl</Name>
      <ElementalCompositionFormula>Cl</ElementalCompositionFormula>
      <Charge>-1</Charge>
    </Adduct>
    <Adduct>
      <Name>Br</Name>
      <ElementalCompositionFormula>Br</ElementalCompositionFormula>
      <Charge>-1</Charge>
    </Adduct>
    <Adduct>
      <Name>Ca</Name>
      <ElementalCompositionFormula>Ca</ElementalCompositionFormula>
      <Charge>2</Charge>
    </Adduct>
    <Adduct>
      <Name>H2O</Name>
      <ElementalCompositionFormula>H2O</ElementalCompositionFormula>
      <Charge>0</Charge>
    </Adduct>
    <Adduct>
      <Name>ACN</Name>
      <ElementalCompositionFormula>CH3CN</ElementalCompositionFormula>
      <Charge>0</Charge>
    </Adduct>
    <Adduct>
      <Name>TFA</Name>
      <ElementalCompositionFormula>CF3COOH</ElementalCompositionFormula>
      <Charge>0</Charge>
    </Adduct>
    <Adduct>
      <Name>FA</Name>
      <ElementalCompositionFormula>HCOOH</ElementalCompositionFormula>
      <Charge>0</Charge>
    </Adduct>
    <Adduct>
      <Name>HAc</Name>
      <ElementalCompositionFormula>CH3COOH</ElementalCompositionFormula>
      <Charge>0</Charge>
    </Adduct>
    <Adduct>
      <Name>MeOH</Name>
      <ElementalCompositionFormula>CH3OH</ElementalCompositionFormula>
      <Charge>0</Charge>
    </Adduct>
    <Adduct>
      <Name>DMSO</Name>
      <ElementalCompositionFormula>C2H6OS</ElementalCompositionFormula>
      <Charge>0</Charge>
    </Adduct>
    <Adduct>
      <Name>NH3</Name>
      <ElementalCompositionFormula>NH3</ElementalCompositionFormula>
      <Charge>0</Charge>
    </Adduct>
  </Adducts>
</ExplicitAbstractIons>
