GC-FTIR Analytics Interface for Compound Detection

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Solution Overview

Problem

Spectrometry-based gas analyzers, such as FTIR and GC-FTIR systems, face challenges in detecting compounds at parts per billion levels and handling multiple compounds or unknowns, leading to difficult spectral data analysis and questionable results.

Innovation Solution

A user interface for a GC-FTIR system that displays chromatogram plots, absorbance spectra, and playback functions, allowing for faster playback of chromatogram signals and spectral data, along with calibration spectral plots and peak tracking, to enhance compound identification and quantification.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Measurement precision

If spectrometry-based gas analyzers (FTIR) are used for environmental compliance applications, then compounds from 0.1 ppm to a few percent levels can be measured, but parts per billion (ppb) detection levels cannot be achieved

Engineering Contradiction:
Improvedetection levelVSAvoidanalysis reliability
Core Design Contradiction:
Measurement precisionVSReliability

Solution Approach 1:

The patent combines gas chromatography (GC) separation system with FTIR spectrometric detection system into an integrated GC-FTIR analyzer. The GC system separates compounds at ppb levels into distinct elution peaks, while the FTIR system provides spectral identification. This merging allows the system to achieve both ppb-level detection precision and reliable compound identification by combining the strengths of both techniques.

Inventive Principle:
Principle #5Merging (Combining)

2Adaptability or versatility

If too many compounds (greater than 10-20) or unknowns are present in the sample, then comprehensive analysis coverage is achieved, but spectral data analysis becomes too difficult and results become questionable

Engineering Contradiction:
Improvecompound coverageVSAvoidspectral data analysis complexity
Core Design Contradiction:
Adaptability or versatilityVSDevice complexity

Solution Approach 1:

The GC column segments the complex mixture into individual compound peaks that elute at different times. Each peak represents a separated compound that can be individually analyzed by FTIR. This segmentation transforms the complex spectral analysis of multiple compounds into a series of simpler, time-separated analyses, making it feasible to handle samples with greater than 10-20 compounds while maintaining analysis reliability.

Inventive Principle:
Principle #1Segmentation

Solution Approach 2:

The GC separation performs preliminary action by pre-separating the compound mixture before spectral analysis. This preliminary separation organizes the complex sample into temporally-resolved individual peaks, so that when FTIR spectral analysis is performed, each spectrum corresponds to a relatively simple, separated compound rather than a complex mixture, greatly simplifying the spectral data analysis.

Inventive Principle:
Principle #10Preliminary action

3Measurement precision

If gas chromatography is used for separating chemical substances, then compounds can be separated based on partitioning behavior, but full peak separation is required to qualify and quantify compounds which increases analysis complexity

Engineering Contradiction:
Improvecompound separationVSAvoidanalysis operation
Core Design Contradiction:
Measurement precisionVSEase of operation

Solution Approach 1:

The FTIR spectrometer acts as an intermediary that provides spectral fingerprints for each eluting compound peak. Instead of relying solely on complex chromatographic peak separation and identification, the FTIR intermediary provides direct molecular identification through absorption spectra, simplifying compound qualification and quantification even when peak separation is not complete.

Inventive Principle:
Principle #24Intermediary (Mediator)

4Measurement precision

If GC detectors with higher sensitivity are used instead of FTIR, then detection sensitivity is improved, but the ability to provide spectral information for compound identification is lost

Engineering Contradiction:
Improvedetection sensitivityVSAvoidspectral information
Core Design Contradiction:
Measurement precisionVSLoss of information

Solution Approach 1:

The FTIR detector in the GC-FTIR system performs multiple functions simultaneously: it provides quantitative detection of compound concentrations (sensitivity function) and provides spectral fingerprints for compound identification (information function). This multi-functionality eliminates the need to choose between sensitive detectors that lack spectral capability and spectral detectors with lower sensitivity, as the FTIR system accomplishes both objectives.

Inventive Principle:
Principle #6Universality (Multi-functionality)

Applied Scientific Principles

This section explains which scientific principles are used to turn an abstract innovation direction into a practical engineering solution.

Function Achieved in This Case

Improves the ability to detect and quantify compounds at low concentrations by providing a user-friendly interface for analyzing chromatogram and spectral data, reducing interference and enhancing detection sensitivity.

Implementation Method 1

It relies on differences in partitioning behavior between a flowing mobile phase (gas phase) and a stationary phase supported in a column to separate the compounds in a mixture

Methodology Applied
Scientific EffectPartitioning: Absorption (physical)

Implementation Method 2

Fourier transform infrared spectrometry system for collecting absorbance spectra of the compounds

Methodology Applied
Scientific EffectAbsorbance spectroscopy: Absorption Spectroscopy

Data Source

PatentUS10802004B2Analytics system and user interface therefor
Publication Date: 2020.10.13 MLS ACQ INC D B A MAX ANALYTICAL TECH
  • US10802004B2 patent drawing
  • US10802004B2 patent drawing
  • US10802004B2 patent drawing

AI summary

An analysis system includes a separation system that provides compounds to a sample cell of a spectrometric system. The system analyzes spectral information from the spectrometric system by optimizing retention windows for the compounds and identifies quantities of the compounds by comparing spectral information within and outside the respective retention windows. Information is displayed in windows of a user interface.