Two-Dimensional Gas Chromatography for Allergen Separation

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Solution Overview

Problem

Current analytical techniques are inadequate for reliably separating and quantifying the 95 known or suspected allergens in complex fragrance compositions, as they fail to provide sufficient resolution and selectivity, posing challenges for regulatory compliance and consumer safety.

Innovation Solution

A novel method using two-dimensional gas chromatography with a stationary phase selection criterion based on clustering analysis, specifically the Separation Efficiency parameter SE2D, to effectively separate and quantify allergens, ensuring a SE2D value above a threshold for optimal resolution.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Measurement precision

If conventional high resolution chromatography techniques are used, then the separation of complex mixtures is achieved, but the resolution and selectivity are insufficient for separating all 95 known or suspected allergens

Engineering Contradiction:
ImproveresolutionVSAvoidability to separate all allergens
Core Design Contradiction:
Measurement precisionVSReliability

Solution Approach 1:

The patent transitions from one-dimensional chromatography to comprehensive two-dimensional gas chromatography (GC×GC), adding a second separation dimension with orthogonal stationary phases. This dimensional expansion increases peak capacity from approximately 100 in 1D to over 1000 in 2D, enabling resolution of all 95 allergens that cannot be separated by conventional 1D methods alone.

Inventive Principle:
Principle #17Another dimension (Dimensionality change)

Solution Approach 2:

The patent employs composite stationary phase systems combining two different phases (e.g., 5% phenyl methyl siloxane and polyethylene glycol) in a GC×GC configuration. This composite approach leverages the complementary separation mechanisms of each phase to achieve orthogonal separations, resolving co-eluting allergens that single phases cannot separate.

Inventive Principle:
Principle #40Composite materials

2Measurement precision

If comprehensive two-dimensional chromatography is used, then peak capacity is increased 9 to 11 times, but the selection of optimal stationary phase combinations becomes iterative and laborious

Engineering Contradiction:
Improvepeak capacityVSAvoidtime for stationary phase optimization
Core Design Contradiction:
Measurement precisionVSLoss of time

Solution Approach 1:

The patent performs preliminary computational analysis using simulated moving bed (SMB) chromatography simulations to predict optimal stationary phase combinations before actual experimental work. This preliminary screening identifies promising phase pairs, reducing the iterative optimization process from potentially dozens of experiments to a focused set of validated combinations.

Inventive Principle:
Principle #10Preliminary action

Solution Approach 2:

The patent uses computational models and simulations to create virtual copies of the chromatographic system, allowing optimization of stationary phase selection in silico before physical implementation. This digital twin approach enables rapid evaluation of multiple phase combinations without consuming analytical time or resources.

Inventive Principle:
Principle #26Copying

3Object-affected harmful factors

If more substances are categorized as potential allergenic substances, then consumer safety is improved, but the complexity of analytical detection increases

Engineering Contradiction:
Improveconsumer safetyVSAvoidanalytical detection complexity
Core Design Contradiction:
Object-affected harmful factorsVSDevice complexity

Solution Approach 1:

The patent employs GC×GC to achieve peak capacities exceeding 1000, providing sufficient resolution to separate and detect all 95 allergens simultaneously in a single analysis. This two-dimensional approach consolidates what would otherwise require multiple sequential 1D chromatographic runs, managing the analytical complexity of detecting expanded allergen lists.

Inventive Principle:
Principle #17Another dimension (Dimensionality change)

Solution Approach 2:

The patent develops a universal GC×GC methodology with standardized conditions, column configurations, and data processing protocols that can detect and quantify any subset of the 95 allergens. This multi-functional approach allows the same analytical system to handle varying regulatory requirements and allergen lists without requiring method redevelopment.

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

This approach enables the reliable separation and quantification of all 95 known or suspected allergens, improving regulatory compliance and consumer safety by ensuring fragrance compositions are free or substantially free of allergens, thereby enhancing the quality of perfumes and cosmetic products.

Implementation Method 1

two-dimensional gas chromatography with a stationary phase selection criterion based on clustering analysis

Methodology Applied
Scientific EffectChromatography: Chromatography

Data Source

PatentUS11002716B2Method of resolving defined known or suspected allergens in a complex mixture of perfume ingredients, and compositions
Publication Date: 2021.05.11 GIVAUDAN SA
  • US11002716B2 patent drawing
  • US11002716B2 patent drawing
  • US11002716B2 patent drawing

AI summary

Analytical methods that can be employed to reliably separate known or suspected allergens in a complex mixture of fragrance ingredients are described.