Mass Spectrometer Software

Chromeleon™ 7.2 Chromatography Data System (CDS) Software

Streamline your laboratory workflow using Thermo Scientific™ Chromeleon™ 7.2 Chromatography Data System (CDS) software. This software delivers superior instrument control, automation, data processing, and more. The first CDS to unify the workflows for chromatography and routine quantitative mass spectrometry (MS) analysis, Chromeleon software provides full integration of Thermo Scientific gas chromatography (GC-MS/MS) and liquid chromatography (LC-MS/MS) instruments. Run your analyses in an enterprise environment—from method creation to final reporting

Enhance Your Workflow Using the Innovative Capabilities of Chromeleon 7 CDS software

  • Industry-leading multi-vendor control—supports over 400 different instrument modules from over 15 manufacturers
  • Full control for all Thermo Scientific chromatography and many Thermo Scientific MS instruments
  • Robust enterprise (client/server) environment with database file storage (SQL Server Express, SQL Server, or Oracle)
  • Secure, administrator-controlled user access and permissions to ensure data integrity and enable compliance with GxP and 21 CFR Part 11
  • Simplified run creation, including sequence, methods and reports, with one-click eWorkflows™
  • Automated pass/fail decisions during runs with Intelligent Run Control to get the analysis right the first time
  • Streamlined MS quantitation, data processing, and NIST spectral library screening
  • Integral Report Designer with customizable, spreadsheet-based report templates with advanced calculations and charting

    • TraceFinder™

    Offer increased flexibility and an array of capabilities in performing targeted screening and routine quantitation with either high resolution accurate mass (HRAM) and/or triple stage quadrupole (TSQ) mass spectrometers with Thermo Scientific™ TraceFinder™ Software. Not only does TraceFinder provide method development tools for all molecule types, it also generates new methods from existing data. From pharma/biopharma to food safety, from environmental safety to clinical research and forensic technology, TraceFinder ensures increased productivity for your analytical laboratory, enabling you to address analytical challenges today and tomorrow

    Discover the Unique Benefits of TraceFinder

  • Streamlined targeted screening and quantitation for all molecule types
  • Easy access to all necessary information for hundreds of molecules in seconds
  • Simplifies workflow-driven method setup with fully automated data acquisition, data processing, and reporting
  • High-resolution isolation (HRI) enables isolation of isobaric mass peaks for cleaner MSn spectra
  • Automates analyses with intelligent sequencing
  • Speeds data processing and reporting with compound database (CDB), smart calibration curves, library search capability, and custom reporting
  • Facilitates data review with multi-peak review capabilities, automatic retention time and ion ratio adjustment, and extensive flagging options
  • Provides quantitative, semi-quantitative, and screening workflows
  • Simplifies operation with system start-up and shut-down methods

    • Mass Frontier™

    Transform mass spectral data into answers, quickly and easily using Thermo Scientific™ Mass Frontier™ spectral interpretation software. Mass Frontier software provides small-molecule structural elucidation for research into metabolism, metabolomics, forensics, natural products, impurities, and degradants. Innovative features simplify the management, evaluation, and interpretation of GC and LC mass spectral data. Mass Frontier software complements Thermo Scientific™ Compound Discoverer software for small molecule research applications

    Intelligent & Easy to Use

  • Predicts fragmentation and generates mechanistic pathways
  • Performs Fragment Ion search (FISh) and FISh Explanation for structurally related components
  • Annotates MSn spectral ion trees, automatically
  • Identifies small molecule structures quickly and confidently using MSn data combined with extensive literature coverage on fragmentation mechanisms
  • Assists de novo structural elucidation using spectra and spectral tree comparison tools
  • Provides customizable and fully searchable user libraries to store spectra, fragments, mechanisms, search results, and more
  • Sorts search results by spectral tree similarity, retention time, m/z value, and molecular formula using the Components Editor
  • Complements MetWorks automated metabolite identification software for the study of biotransformations
  • Complements MetQuest automated qual/quan metabolic screening software for simultaneous quan/qual drug metabolism and pharmacokinetic analysis

    • TargetQuan™

    Quantify persistent organic pollutants (POPs), routinely in a regulated environment, using Thermo Scientific™ TargetQuan 3 software. Uniquely tailored for workflow-driven POP quantification, the software provides comprehensive processing of MS, MS/MS and high-resolution MS data on a single software platform. TargetQuan 3 software supports LC-MS and GC-MS data, including high-resolution GC-MS data

    Quantifies

  • Dioxins and furans
  • Polychorinated biphenyls
  • Brominated flame retardants
  • Polybrominated diphenyl ethers
  • Polychlorinated napthalenes
  • Other target compounds requiring isotope dilution techniques