Start adding PDA specta export

Author: caetera

ThermoRawFileParser.csproj.user

@@ -1,6 +1,6 @@
 <?xml version="1.0" encoding="utf-8"?>
 <Project ToolsVersion="15.0" xmlns="http://schemas.microsoft.com/developer/msbuild/2003">
   <PropertyGroup Condition="'$(Configuration)|$(Platform)' == 'Debug|x64'">
-    <StartArguments>-i=C:\Users\Iman\Desktop\RawFiles\FileReaderTest\blacktea_1.raw -f=2 -o .\</StartArguments>
+    <StartArguments>-i=C:\Code\QC_MSDDA_UV.raw -f=1 -o=C:\Code -a</StartArguments>
   </PropertyGroup>
 </Project>

Writer/MgfSpectrumWriter.cs

@@ -65,7 +65,7 @@ public override void Write(IRawDataPlus rawFile, int firstScanNumber, int lastSc
                         IReaction reaction = GetReaction(scanEvent, scanNumber);
 
                         Writer.WriteLine("BEGIN IONS");
-                        Writer.WriteLine($"TITLE={ConstructSpectrumTitle(scanNumber)}");
+                        Writer.WriteLine($"TITLE={ConstructSpectrumTitle((int)Device.MS, 1, scanNumber)}");
                         Writer.WriteLine($"SCANS={scanNumber}");
                         Writer.WriteLine(
                             $"RTINSECONDS={(time * 60).ToString(CultureInfo.InvariantCulture)}");