Specifications. MassHunter WorkStation for Agilent 7700 Series ICP-MS. Specifications: MassHunter Workstation (G7211A) for the Agilent 7700 Series

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1 Specifications MassHunter WorkStation for Agilent 7700 Series ICP-MS Specifications: MassHunter Workstation (G7211A) for the Agilent 7700 Series The ICP-MS MassHunter Workstation for the Agilent 7700 Series ICP-MS replaces the previous G7210B bundle and provides a comprehensive software package for instrument control, method setup, acquisition and data analysis with the 7700 Series. Based on Agilent s renowned MassHunter platform, the new revision of ICP-MS MassHunter provides a common software environment across Agilent s LC/MS, GC/MS and ICP-MS systems, simplifying the transfer of skills across the laboratory. ICP-MS MassHunter Workstation for the 7700 Series is configured in 2 different versions: Core version, which is supplied as standard with the new 7700e instrument, and is focused on simplified operation for common, routine and well-defined applications Full version, which is supplied with the 7700x and 7700s models, and delivers high levels of flexibility, advanced functionality and can be upgraded with optional software modules The Core version can be upgraded to the Full version, if lab requirements change in the future. 1

2 Agilent ICP-MS MassHunter features include: Operates on Windows 7, 32 bit version only (also compatible with but not supported on Windows Vista ) Support for long, descriptive filenames Full control of 7700 Series ICP-MS hardware (not compatible with 7500 Series ICP-MS) Direct control of accessories and peripherals, such as autosamplers and Agilent LC and GC systems (LC/GC control requires Full version of MassHunter and optional software module) Comprehensive diagnostic and Early Maintenance Feedback (EMF) tools Fast and reproducible auto-tuning for ICP-MS system and all major hardware components Startup function for automated system checks and hardware optimization Pre-defined analysis using Pre-Set Methods and Pre-Set Plasma Conditions Batch concept for integrated method and sequence setup (Acquisition & Tune conditions, Data Analysis parameters and Sample List) Quick Scan for fast screening analysis Queue view for flexible, interactive sequencing, with scheduled task list, current sequence status and real-time display including Monitor function and run time indicator Advanced rinse programs including Pre-emptive Rinse and Intelligent Rinse Includes Time Resolved Analysis* Batch Table overview of Data Analysis results, with real-time update during sequence run Interactive data view shows internal standard recovery and analyte concentration on calibration plot for current sample Built in outlier flagging with user-defined flags Calibration overview with flexible real-time editing of calibration parameters Real-time plotting of ISTD and QC results LabQC results and plotting included Advanced tools for spectral analysis and semi-quantitative analysis, including overlay and automated isotopic template update Snapshot for preview analysis of currently acquiring time resolved data* Isotope ratio/isotope dilution analysis included* Fast and simple link to Excel 2010 for reporting and data export (e.g. to LIMS) Same data analysis view for spectrum and chromatographic* data Compatible with OpenLab ECM* * Full version only Startup and Hardware Optimization Both versions of the MassHunter software provide full control of the 7700 Series ICP-MS, including automated Startup and optimization procedures; automated, unattended system shutdown at the end of a sequence is also available. Startup provides a simple, user-configured schedule of system optimization and performance checks to be run following plasma ignition. A pre-defined warm-up period is included, and Startup tasks are run under standard operating conditions, to give a consistent record of system performance. Startup is particularly useful in busy commercial laboratories, as it ensures that performance is consistent from day to day, and from operator to operator. Typical Startup tasks, such as Torch Axis (horizontal and vertical alignment with the interface orifice) and Plasma Correction, can be followed by generation of a standard Performance Report, which gives a continuing record of system performance. The Performance Report provides a graphical display of key system performance parameters (sensitivity, oxides, background, mass calibration and resolution, etc). The report viewer also includes a History view, which allows users to monitor system performance over time. In addition to system performance, the Performance Report also saves all the current tune and meter values, giving a record of system operating parameter settings. The Hardware pane contains a graphic of the main system components, providing the user interface for all hardware functions, including system configuration, individual sub-system optimization and maintenance, Early Maintenance Feedback (EMF), diagnostics, and Performance Reports. The instrument graphic updates automatically when different system hardware modules (such as a different autosampler, LC or GC modules) are selected. Early Maintenance Feedback (EMF) is included with the MassHunter software, providing a flexible monitor of system running time. All major maintenance items are monitored as standard, and user-settable additional maintenance flags can be defined. A built-in maintenance log allows users to record routine maintenance actions for lab management and audit purposes; full system error logging is included, with a plain text log of all errors. 2

3 Remote diagnostics are available and simple archive and restore functions provide easy access to system data for support investigation. Using a single user interface for all system setup, maintenance and diagnostic functions ensures that users have all the information on system operation easily available at all times. Batch The Batch pane brings together all the information required for a sample analysis session or experiment, including peripump program, tune modes, acquisition parameters, sample list and data analysis (calibration) parameters. All these parameters are saved in the Batch and can be recalled for use in subsequent sample analysis. The Batch concept is a major innovation for the ICP-MS MassHunter platform, as it simplifies file management and ensures that consistent conditions can be used for regular or routine sample analysis. A new Batch can be created from a blank template, an existing Batch, or one of a series of Pre-Set Methods which ship with the software. Pre-Set Methods pre-define all critical parameters for many typical applications, with separate methods provided for each 7700 Series model. In addition to defining the analyte list, integration times, internal standards and cell gas modes, the Pre-set Method also defines the autotune parameter default values and tuning ranges, ensuring that the system is perfectly optimized for the application. A unique feature of Pre-Set Methods on the 7700 is the use of Pre-Set Plasma Conditions, where settings suitable for low, medium or high-matrix samples can be preselected and used repeatably, based on a plasma map which is automatically calibrated for each instrument. For application-specific operating conditions, Expert AutoTuning simplifies optimization and delivers consistent reproducible instrument performance from day-to-day, even with multiple operators. Expert AutoTuning provides fast and consistent setup of plasma conditions, including high matrix introduction (HMI) dilution settings (7700x only), ion lens voltages, and cell conditions. A Tune Report can be generated when the user chooses, or automatically as part of a Batch acquisition. Data Acquisition Parameters ICP-MS MassHunter provides a range of data acquisition modes: Single mass monitoring Peak jumping Scanning Segmented scanning MassHunter Full version providers flexible, Time Resolved Analysis (TRA), with user-set acquisition and tune conditions for each time program step. The number of replicates, peak pattern and integration time are user settable, allowing full flexibility for spectrum analysis (peak profile view) and optimized acquisition times for quantitative, semiquant and time resolved acquisitions. A periodic table interface (below) allows users to easily select analytes and internal standard masses. A user-editable database predefines the preferred isotope for each analyte, and the prohibited masses for each tune mode, simplifying method setup. Complete flexibility is provided for the user to select any analyte or isotope to be acquired in any tune step (e.g. gas mode). Each analyte can be acquired in multiple tune steps for method development, and tune steps may be run in any order, with user-settable delay times between. A Quick Scan acquisition can be selected to run for any tune step, giving a rapid screening analysis for each sample, in addition to the main quantitative or isotope analysis measurement. 3

4 Sequencing The Batch also contains the sequence sample list, thereby allowing routine sample analysis to be repeated easily using the same sample list template. Sample list controls include flexible dilution factor calculation (e.g. based on imported wt/vol values), variable numbers of replicates on a per-sample basis, direct method control for integrated accessories (such as Agilent LC and GC systems) and common edit functions including cut/paste, copy, fill down, skip samples, etc. Autosampler vial positions may be entered manually, pasted from a csv file, or selected from an intuitive autosampler vial map. Full access to the sample list is retained while the sequence is running, allowing the currently running sequence to be paused for editing, e.g. to add a rush sample. The user can choose at which point the current batch is paused, so a calibration block may be allowed to finish before pausing, for example. Queue The Queue contains an interactive schedule listing individual Hardware tasks (such as the performance checks run during Startup) and Batches awaiting analysis, together with the interactive Sample List table for the current Sequence, and the Real-Time Display for the current sample. The Queue view also includes a Monitor function (shown above), which displays the signals for several user-selected masses in the period between acquisitions. As well as a visual rinse monitor, this provides an indication that the next sample has reached a steady signal before acquisition. At any time, the scheduled tasks and Batches waiting in the Queue list can be moved, edited or deleted, allowing the user full flexibility to control the analysis progress. The real-time view shows the current sample acquisition during sequence analysis in either spectrum or TRA mode ( Full version only). In TRA acquisitions a Snapshot function is provided to transfer the current acquisition sample data to the Data Analysis pane for processing while the acquisition completes. Data Analysis Data Batch View Acquired data in MassHunter is automatically displayed in a Data Batch view, which has a flexible, user-selectable table format. Outlier flags are also user-selectable and the sample view may be filtered based on outlier status. The Data Batch table is updated in real-time during sequence analysis, and the flexible layout can include the sample header information, sample data (counts, concentration, SD, %RSD), the internal standard counts and recovery, LabQC recovery, calibration plots (either summary or detail) and flexible outlier flags. The batch table is interactive, allowing users to move up and down the table to display the current sample spectrum/chromatogram, the internal standard recovery for the current sample, and the calibration curve for the current analyte. 4

5 Calibration All data acquired using MassHunter is available for processing using any data analysis mode. For example, data acquired for quantitative analysis may also be processed using isotope ratio analysis*, or semi-quantitative calibration, to give approximate concentrations for uncalibrated elements. The calibration method may be changed and the data reprocessed at any time during or post-acquisition. Calibration curves can be shown as a summary (12 plots, illustrated bottom left), or as individual plots (shown below). Calibration modes include External calibration Method of standard additions Semi-quantitative calibration Isotope ratio* Isotope dilution* * Full version only Calibration curve fit options include linear, linear through zero, linear through the blank, weighted least squares, log and second order. Users have full flexibility to change the curve fit, exclude individual points, change internal standards or switch internal standard correction on or off. The curve is updated immediately and any changes are easily applied to all samples in the batch. Recalibrations during the sequence are applied automatically to the samples run after the recalibration, including converting standard addition to external calibration, isotope ratio mass bias correction, and semi-quantitative calibration. Full curve statistics are available, including counts for each point, calibration recovery (read-back), background equivalent concentration (BEC) and detection limit (DL). The concentration of the currently selected sample is shown on the calibration plot, and the displayed concentration updates for each sample as the user scrolls through the Data Batch table. Spectrum Analysis Simple spectra are one of the beneficial characteristics of ICP-MS, especially when combined with interference removal using helium (He) mode. The spectrum analysis tools included in ICP-MS MassHunter provide an ideal interface to view and interpret these spectra. Advanced tools include: Full control of scale, log/linear, zoom and scroll functions for the displayed spectrum Simple data comparison, using overlays of the spectra for different tune steps/modes from the same sample, or of the same tune step for different samples (illustrated below) Unlimited isotopic templates displayed on the spectrum, with automatic recalculation of the templates for the current sample, as the user scrolls up and down the Data Batch table. 5

6 Chromatographic Data The optional Chromatographic Data module (available only for the Full version of ICP-MS MassHunter) allows chromatographic data to be shown in the same way as spectrum data. The current chromatogram is displayed, and outlier functions and calibration options are provided as for spectrum mode. Advanced chromatographic functions include: Auto-integration using user-selectable integration parameters Snapshot data analysis of current sample Compound-independent calibration (CIC) Signal to Noise calculation Retention time recalibration Automatic and flexible peak detection Compliance Software Qualification Validation tools for installation qualification (IQ) and operation qualification (OQ) are available for ICP-MS MassHunter, providing full documentation for audit purposes. Reporting Flexible Report Format MassHunter includes a flexible, user-configurable report layout interface for custom reporting, Built-in reports includes quant, semi-quant and isotope ratio reports for individual samples, and a flexible quick batch report for full or selected batch table data. 21 CFR Part 11 Compliance In combination with User Access Control (G7207A) and Agilent s OpenLab ECM, ICP-MS MassHunter can provide a complete 21 CFR Part 11 compliant software environment for ICP-MS. In addition to printed reports, the sample data and batch table are compatible with electronic reporting, with direct export to Excel, and file formats such as.csv and.txt providing simple connection to LIMS and other electronic report packages. 6

7 MassHunter Workstation for the 7700 Series; Software Functionality Table for Core (7700e) and Full (7700x and 7700s) Versions Core (7700e) Full (7700x/7700s) Time Resolved Analysis (TRA) Mode No Yes Isotope Ratio/Isotope Dilution No Yes High-Resolution/Half-Mass Mode (used for correction of doubly-charged interferences) No Yes High Matrix Introduction function (HMI) No Yes (7700x only) Fast Cell Gas Switching Manual Plasma Condition Setting Option Tuning Mode Spray Chamber Temperature Control No (requires upgrade to Full Version & cell gas bypass valve upgrade) No Autotuning only Fixed 2 o C Yes Yes Autotuning or flexible manual tuning Selectable (-5 o C to 20 o C) Quick Scan No Yes ISIS Control Optional Software Modules (Intelligent Sequencing, Chromatographic Analysis, User Access Control) Requires upgrade to Full Version Requires upgrade to Full Version Optional Optional Note: To enable advanced features for 7700e, an upgrade to the full version of MassHunter Workstation software for the 7700 is required. Order product number G7208A. 7

8 MassHunter Workstation PC Bundle for the 7700x and 7700s (MassHunter Workstation PC Bundle with Core version of MassHunter is included with the 7700e System) Specifications (subject to change without notice) G7211A Agilent MassHunter Workstation for 7700 ICP-MS Agilent s ICP-MS MassHunter Workstation includes PC, monitor, printer, Windows 7 (32 bit version), Excel 2010, ICP-MS MassHunter software (revision G7201A) and Manuals. PC: HP DC8000 Elite (Small Form Factor) Processor Type: Intel Core 2 Duo Processor E8500 Processor Speed: 3.16 GHz RAM: 2 GB DDR3 Hard Disk: 250 GB (7200 rpm, SATA) Optical Drives: DVD+RW Double Layer LightScribe LAN port: Integrated Intel 82566DM Gigabit Network Connection Graphics: Integrated Intel Graphics Media Accelerator 3100 Audio: Integrated High Definition audio with ADI1884 Accessories: Keyboard and Optical Mouse Operating System: Windows 7 Professional, 32 bit (English) Monitor: HP LP2245wg 22" LCD Laser Printer: HP LaserJet P3015 (600 sheets tray capacity / 35ppm) Note 1: The ICP-MS MassHunter PC Bundle shown above includes the most recent revision of MassHunter software (G7201A - Subaru). The previous revision of software (G7200B, Metis3) is also available (until Feb 2011) and the PC Bundle with this software can still be ordered using G7210B. G7210B includes the same PC hardware and Operating System as G7211A, but ships with MS Excel 2007 instead of Excel Note 2: The ICP-MS is connected to the instrument control PC using the standard LAN port of the PC. If a second LAN connection is required, for example to connect the PC to a building LAN or to control an Agilent LC or GC system, a LAN switch (switching hub) such as the HP ProCurve Network Switch (G2402A) is recommended. It is possible to use a second LAN card, but communication problems are commonly reported with this configuration, so the preferred and supported configuration is with a network switch. 8

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