安捷伦6410液质联用资料 New Era in LC-MS Quantitative Analysis(Agilent MassHunter Workstation ).ppt

NewErainLC MSQuantitationAgilentRestricted May31 2006 Page1 NewErainLC MSQuantitativeAnalysis Agilent6410TripleQuadLC MSAgilentMassHunterWorkstationAgilentTechnologies Inc LifeSciencesandChemicalAnalysisFrankKuhlmannSeniorScientistLC MSSoftwareDevelopmentASMS2006 31 May 2006 NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page2 Program Agilent6410QQQHardware 10min Performance Reliability Ease of Use CostofOwnershipAgilentMassHunterWorkstationSoftware 30min FastLearningCurve Ease of Use Productivity ReportingAcquisitionSoftwareQuantitativeAnalysisSoftwareFeatures LifeDemosBatch At AGlanceUserInterfaceandNavigationQuantMethodEditorOutlierFlaggingandFilteringonover20ParametersParameter lessMSMSIntegratorw built inpeakvalidationCurveFitAssistantandotherProductivityToolsPowerfulreportingbasedonExcel2003ProandXML LifeDemoFuture21CFRPart11ComplianceAutomatedMRMAcquisitionMethodDevelopmentSupportofallAgilentMSinstrumentation LC MS GC MS ICP MS Questions NewErainLC MSQuantitativeAnalysis NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page3 Program Agilent6410QQQHardware 10min Performance Reliability Ease of Use CostofOwnershipAgilentMassHunterWorkstationSoftware 30min FastLearningCurve Ease of Use Productivity ReportingAcquisitionSoftwareQuantitativeAnalysisSoftwareFeatures LifeDemosBatch At AGlanceUserInterfaceandNavigationQuantMethodEditorOutlierFlaggingandFilteringonover20ParametersParameter lessMSMSIntegratorw built inpeakvalidationCurveFitAssistantandotherProductivityToolsPowerfulreportingbasedonExcel2003ProandXML LifeDemoFuture21CFRPart11ComplianceAutomatedMRMAcquisitionMethodDevelopmentSupportofallAgilentMSinstrumentation LC MS GC MS ICP MS Questions NewErainLC MSQuantitativeAnalysis NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page4 Forfoodsafety environmental chemical forensics pharmaceuticalandmetabolomicsmarkets HighanalyticalperformanceReliabilityEaseofuseLowcostofownership WhatarethebiggestissueswhichcustomersfaceinQQQLC MS MSQuantitationHARDWARE DesignObjectivesforthe6410TripleQuadLC MS NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page5 Performance BentazonHerbicide100fgLOQ Femtogramsensitivitywithexcellentreproducibility MRMParameters 3transitions100msecdwell transition315mseccycletime239 8 238 9 precursorion 239 8 132 0 quantifierion 239 8 196 8 qualifierion NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page6 Performance ReserpineinCoffee160fgLOQ NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page7 Reliability Agilent6410TripleQuadLC MS PatentedOrthogonalIonSourceDesignsSuperiorhandlingofanyflowrateandhighmatrixsamplesNoX Y ZadjustmentAgilentQualityEngineeringHeritageStableSoftwareandFirmwareduetoExtensiveStressTestingLeverageofProvenDesignsfromQuadandTrapIonOptics VacuumSystem ElectronicsSharedcomponentswithQ TOFandSingleQuadLessparts bettersupportability NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page8 EaseofUse Agilent6410TripleQuadLC MS AutotunethattrulyworksandensurestopperformanceBuilt inCalibrantDeliverySystemAutomaticGenerationofIonBreakdownProfilesDetermineoptimumCollisionEnergiesforeachtransitionIonOpticsandCollisionCellDesignwithbroadmasstransmissionOnlyveryfewparameterstooptimize CollisionEnergy V Fragment1 Fragment2 Abundance NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page9 LowCostofOwnership 6410TripleQuadLC MS 30 50 lowercostthancompetitivetriplequads IonPulser Turbo2 Octopole1 DCQuad RoughPump Turbo1 Turbo1 Turbo1 QuadMassFilter Q1 CollisionCell Lens1and2 Octopole2 QQQAnalyzer QTOFAnalyzer OrthogonalIonSourceQuadrupoleIonOpticsVaccuumSystem Newaxialaccelerationcollisioncelldesign LeveragingHWdesignbetweenQQQ Q TOF QandTrapAgilentlowcosthighqualityengineering NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page10 Program Agilent6410QQQHardware 10min Performance Reliability Ease of Use CostofOwnershipAgilentMassHunterWorkstationSoftware 30min FastLearningCurve Ease of Use Productivity ReportingAcquisitionSoftwareQuantitativeAnalysisSoftwareFeatures LifeDemosBatch At AGlanceUserInterfaceandNavigationQuantMethodEditorOutlierFlaggingandFilteringonover20ParametersParameter lessMSMSIntegratorw built inpeakvalidationCurveFitAssistantandotherProductivityToolsPowerfulreportingbasedonExcel2003ProandXML LifeDemoFuture21CFRPart11ComplianceAutomatedMRMAcquisitionMethodDevelopmentSupportofallAgilentMSinstrumentation LC MS GC MS ICP MS Questions NewErainLC MSQuantitativeAnalysis NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page11 LearningCurveEaseofUseProductivityinDataProcessingReportingInteroperability DesignObjectivesforMassHunterWorkstationSW WhatarethebiggestissueswhichcustomersfaceinQQQLC MS MSQuantitationSOFTWARE NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page12 AgilentMassHunterWorkstationSoftware MassHunterAcquisitionSoftware MassHunterQualitativeAnalysisSoftware MassHunterQuantitativeAnalysisSoftware CustomReportingbasedonExcel2003andXMLtechnology AdressingtheNeed MassHunterQualitativeAnalysisSoftware NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page13 AgilentMassHunterWorkstationSoftware Completelynew MassSpectrometrySW IntegratedsystemcontrolofallLCandMS QTOF QQQ TOF operatingparameters NextGenerationSoftwareforLC MSQuantitativeAnalysis Uncompromisinguseofindustrystandards dotNET andopenarchitecture XML PowerfulfunctionalGraphicalUserInterfacesEnablesstraightforwardintegrationintoexistingITenvironments NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page14 AgilentMassHunterWorkstationSoftware Flat UserInterface Ease of UseMinimizeswitchingofViewstoseeallrelevantinformationAt A GlanceAvoidingpop updialogboxeswhichfloataboveandpreventaccesstoimportantinformationunderneathMinimizeMouseTravelandMouseClicks UserInterfaceDesignConcepts UserInterfacedesignedforApplicationTask Flow LearningCurveDynamiclinkingofinformationwhichisassociatedwithacompoundTaskEditorswhichallowtofocusonsub tasksintheworkflowProductivityToolstoeaserepetitiveandtime consumingtasks NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page15 AgilentMassHunterAcquisitionSW AcqMode SystemDiagram InstrumentActuals Status configurable Real TimeSpec ChroDisplay MethodEditorLC MS Worklist Sequence Flat UserInterfaceAllInfoAt A Glance NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page16 AgilentMassHunterAcquisitionSW TuneMode TuneMassProfiles ParameterRamps ManualTuneParameterEditor AutoTune Flat UserInterfaceAllInfoAt A Glance NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page17 AgilentMassHunterQuantitativeAnalysisSW UnprecedentedProductivityinProcessingandReviewinglargemulti compoundbatches QuantEnginebasedonthepowerfulandprovenGC MSQuantEngine augmentedforMS MSSupportofQualifierIons nowMS MS SupportofSurrogatesandMatrixSpikesSupportofover20OutliercriteriaPowerful yetEasy to UseforthemostcommonMRMquantitationUsingXMLDatabasetostoremethodandresultsPowerfulReportingusingExcel2003Professional NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page18 AgilentMassHunterQuantSW Batch At A Glance BatchTable CompoundInformation Chroms Specs CalibrationCurve CurveFitAssistant Sample orCompound CentricOrthogonalNavigation Context locatedToolstrips Demo NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page19 AgilentMassHunterQuantSW MethodEditor Columnswhichneedentryaremarkedblue NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page20 AgilentMassHunterQuantSW QuantMethod CompoundInfoCompoundNameRetentionTimeTimeSegmentPrecursorIonFragmentIonSampleTypeScanType MRM MS AcquisitionMethod QuantMethod What sleft Target ISTDAssignmentConcentrationSetupOPTIONAL OutlierSetup Demo NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page21 Parameter LessIntegratorwPeakValidation Parameter LessMSMSIntegrator Traditionalderivative basedIntegrator MissedPeaks BadBaseline Addition Peaks Traditionalderivative basedintegratorsneedtediousadjustmentofintegrationparametersperformpoorlyneartheLowerLimitofQuantitationneedtoapplysmoothingtowork NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page22 Parameter LessIntegratorwPeakValidation Newparameter lessMSMSIntegratordoesnothaveANYparametersdiscriminatesbetweenpeaksandspikesintegratescorrectfromlowesttohighestconc virtuallyeliminatesmanualintegration Performanceover4ordersofmagnitude NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page23 Parameter LessIntegratorwPeakValidation Newparameter lessMSMSIntegratordoesnotneedsmoothing Comparisonwithandwithoutsmoothing 5inj of670fgofHomocysteine transition136 90m z Area676 Area717 Area631 Area654 Area623 Area667 Area711 Area741 Area620 Area675 RSD6 7 RSD5 4 AdditionalPeaks NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page24 Parameter LessIntegratorwPeakValidation Newparameter lessMSMSIntegratorvalidatesPeakQualitybasedonPeakheightPeakareaPeakwidthPeaksymmetryMergedpeakstotherightorleftLevelofspikesonapeakClassifiespeakqualityasAcceptedInspectRejectedLet syoufocusonpeaksinquestion MergeValleyHeight15 PeakAccepted MergeValleyHeight39 InspectPeak MergeValleyHeight54 PeakRejected NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page25 Program Agilent6410QQQHardware 10min Performance Reliability Ease of Use CostofOwnershipAgilentMassHunterWorkstationSoftware 30min FastLearningCurve Ease of Use Productivity ReportingAcquisitionSoftwareQuantitativeAnalysisSoftwareFeatures LifeDemosBatch At AGlanceUserInterfaceandNavigationQuantMethodEditorOutlierFlaggingandFilteringonover20ParametersParameter lessMSMSIntegratorw built inpeakvalidationCurveFitAssistantandotherProductivityToolsPowerfulreportingbasedonExcel2003ProandXML LifeDemoFuture21CFRPart11ComplianceAutomatedMRMAcquisitionMethodDevelopmentSupportofallAgilentMSinstrumentation LC MS GC MS ICP MS Questions NewErainLC MSQuantitativeAnalysis NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page26 PowerfulReportingusingExcel2003Pro XML ChooseReportTemplateQueueupMultipleReportsChoosePrinter PDF e mail ExcelislaunchedTemplateisloadedResultsareimportedReportisformattedReportis a savedasXLSb OPT sendtoPrinterc OPT savedasPDFd OPT E mailed ReportResults XML Graphicsaregenerated NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page27 EasycustomizationusingfamiliarExcelFeatures DraganddropcolumnsfromXMLresults Addtablesandgraphicsusingtoolbuttons PrintPreview FormatHeaders FootersusingExcel UseConditionalFormattingforOutlierFlagging UseExcelNumberFormatting Demo NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page28 Program Agilent6410QQQHardware 10min Performance Reliability Ease of Use CostofOwnershipAgilentMassHunterWorkstationSoftware 30min FastLearningCurve Ease of Use Productivity ReportingAcquisitionSoftwareQuantitativeAnalysisSoftwareFeatures LifeDemosBatch At AGlanceUserInterfaceandNavigationQuantMethodEditorOutlierFlaggingandFilteringonover20ParametersParameter lessMSMSIntegratorw built inpeakvalidationCurveFitAssistantandotherProductivityToolsPowerfulreportingbasedonExcel2003ProandXML LifeDemoFuture21CFRPart11ComplianceAutomatedMRMAcquisitionMethodDevelopmentSupportofallAgilentMSinstrumentation LC MS GC MS ICP MS Questions NewErainLC MSQuantitativeAnalysis NewErainLC MSQuantAnalysisAgilentRestricted May31 2006 Page29 Intranet Internet GC CE LC Lab on aChip GC MS MassHunterWorkstation ICP MS UV vis AgilentOpenLAB LaboratoryInformatics 21CFRPart11ComplianceFeatures 2ndRelease LC MS AuditTrail MassHunterQuantitativeAnalysisSW UserManagement OpenLAB ResultsRevisioning OpenLAB ElectronicSignatures OpenLAB Archiving OpenLAB NewErainLC MSQuantAnalysisAgil