<?xml version="1.0"?>
<mzML xmlns="http://psi.hupo.org/ms/mzml" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://psi.hupo.org/ms/mzml http://psidev.info/files/ms/mzML/xsd/mzML1.1.0.xsd" id="JKQXZKUSFCKOGQ-QAYBQHTQSA-N" version="0.1">
  <cvList count="2">
    <cv id="MS" fullName="Proteomics Standards Initiative Mass Spectrometry Ontology" version="2.26.0" URI="http://psidev.cvs.sourceforge.net/*checkout*/psidev/psi/psi-ms/mzML/controlledVocabulary/psi-ms.obo"/>
    <cv id="UO" fullName="Unit Ontology" version="14:07:2009" URI="http://obo.cvs.sourceforge.net/*checkout*/obo/obo/ontology/phenotype/unit.obo"/>
  </cvList>
  <fileDescription>
    <fileContent>
      <cvParam cvRef="MS" accession="MS:1000127" name="centroid spectrum" value=""/>
    </fileContent>
    <sourceFileList count="1">
      <sourceFile id="_HMDB0002789_2_peaks.tsv" name="HMDB0002789_2_peaks.tsv" location="http://mcdb.cahttp://moldb.wishartlab.com/system/documents/files/002/857/682/original/HMDB0002789_2_peaks.tsv?1632172623">
        <cvParam cvRef="MS" accession="MS:1001369" name="text file" value=""/>
      </sourceFile>
    </sourceFileList>
    <contact>
      <cvParam cvRef="MS" accession="MS:1000586" name="contact name" value="David Wishart"/>
      <cvParam cvRef="MS" accession="MS:1000590" name="contact organization" value="University of Alberta"/>
      <cvParam cvRef="MS" accession="MS:1000587" name="contact address" value="University of Alberta, Edmonton, Alberta, Canada, T6G 2E8"/>
      <cvParam cvRef="MS" accession="MS:1000588" name="contact URL" value="http://wishartlab.com"/>
      <cvParam cvRef="MS" accession="MS:1000589" name="contact email" value="david.wishart@ualberta.ca"/>
    </contact>
  </fileDescription>
  <softwareList count="1">
    <software id="SpecDB" version="0.1">
      <cvParam cvRef="MS" accession="MS:1000799" name="custom unreleased software tool" value="SpecDB Spectra management database"/>
    </software>
  </softwareList>
  <instrumentConfigurationList count="1">
    <instrumentConfiguration id="instrument">
      <cvParam cvRef="MS" accession="MS:1000031" name="instrument model" value=""/>
    </instrumentConfiguration>
  </instrumentConfigurationList>
  <dataProcessingList count="1">
    <dataProcessing id="SpecDB_processing">
      <processingMethod order="1" softwareRef="SpecDB">
        <cvParam cvRef="MS" accession="MS:1000544" name="Conversion to mzML" value=""/>
      </processingMethod>
    </dataProcessing>
  </dataProcessingList>
  <run id="run_1" defaultInstrumentConfigurationRef="instrument" defaultSourceFileRef="_HMDB0002789_2_peaks.tsv">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_HMDB0002789_2_peaks.tsv" index="0" defaultArrayLength="70">
        <cvParam cvRef="MS" accession="MS:1000580" name="MSn spectrum" value=""/>
        <cvParam cvRef="MS" accession="MS:1000127" name="centroid spectrum" value=""/>
        <binaryDataArrayList count="2">
          <binaryDataArray encodedLength="761" dataProcessingRef="SpecDB_processing">
            <cvParam cvRef="MS" accession="MS:1000523" name="64-bit float" value=""/>
            <cvParam cvRef="MS" accession="MS:1000576" name="no compression" value=""/>
            <cvParam cvRef="MS" accession="MS:1000514" name="m/z array" value="" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
            <binary>FK5H4XpEV0A9CtejcMVXQD0K16NwxVpAWDm0yHZGW0Av3SQGgcVdQNnO91Pj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</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="761" dataProcessingRef="SpecDB_processing">
            <cvParam cvRef="MS" accession="MS:1000523" name="64-bit float" value=""/>
            <cvParam cvRef="MS" accession="MS:1000576" name="no compression" value=""/>
            <cvParam cvRef="MS" accession="MS:1000515" name="intensity array" value="" unitCvRef="MS" unitAccession="MS:1000131" unitName="number of counts"/>
            <binary>rkfhehSuFEAUrkfhehQYQArXo3A9iiBAzczMzMxMJkApXI/C9Wg5QI/C9Shc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</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
