GCMS
More information
WebinarsAbout usContact usTerms of use
LabRulez s.r.o. All rights reserved. Content available under a CC BY-SA 4.0 Attribution-ShareAlike
Author
The Multidimensional Chromatography (MDC) Workshop
The Multidimensional Chromatography (MDC) Workshop draws experts in this exciting field to share and discuss their research.
Tags
Presentation
Video
Food
Logo of LinkedIn

Sensory-classified roasted arabica coffee with GC×GC-TOFMS and chemometrics (Caitlin Cain, MDCW 2024)

We, 3.4.2024
| Original article from: The Multidimensional Chromatography (MDC) Workshop
This work develops a volatile fingerprint of potato taste defect (PTD) in roasted arabica coffee using HS-SPME-GC×GC-TOFMS and chemometrics.
Video placeholder
  • Photo: MDCW: Sensory-classified roasted arabica coffee with GC×GC-TOFMS and chemometrics (Caitlin Cain, MDCW 2024)
  • Video: LabRulez: Caitlin Cain: Sensory-classified roasted arabica coffee with GC×GC-TOFMS and chemometrics (MDCW 2024)

🎤 Presenter: Caitlin Cain¹, Meriem Gaida², Pierre-Hugues Stefanuto², Jean-François Focant², Robert Synovec¹, Susan Jackels³, Kristen Skogerboe³ (¹University of Washington, Seattle, USA, ²University of Liège, Liège, Belgium, ³Seattle University, Seattle, USA)

💾 PDF presentation

💡 Book in your calendar: 16th Multidimensional Chromatography Workshop (MDCW) 3 - 5. February 2025

Abstract

As coffee consumption increases globally, demands for specialty and/or high-quality coffee beans are primarily driven by consumer preferences toward the taste and aroma of the final brew. However, the presence of chemical defects can negatively impact the sensory properties of coffee. Potato taste defect (PTD), unique to East African coffee, is characterized by a distinct musty, vegetable, raw potato aroma due to the presence of 2-isopropyl-3-methoxypyrazine (IPMP). This work develops a volatile fingerprint of PTD in roasted arabica coffee using headspace-solid-phase microextraction-comprehensive two-dimensional gas chromatography with time-of-flight mass spectrometry (HS-SPME-GC×GC-TOFMS) and chemometrics.

Tile-based Fisher ratio (F-ratio) analysis discovered over 300 volatiles that discriminated clean (i.e., no off-odor) coffee samples from those identified as having a strong PTD odor (p-value less than 0.01). Analytes associated with unpleasant sensory descriptions were positively correlated with the odor of PTD, while analytes associated with desirable aromas were found to be negatively correlated with odor severity. Principal components analysis (PCA) highlighted that the coffee samples clustered based on the presence of PTD. Furthermore, use of the class-distinguishing analytes discovered by F-ratio analysis for partial least squares (PLS) regression produced accurate models of IPMP concentration with low prediction errors (~ 10 % error). Investigation of the PCA and PLS loadings revealed the volatile compounds which are most important to predicting PTD in roasted coffee. Ultimately, these results reveal the complex volatile signature of PTD in East African coffee beans, demonstrating that the defect has outcomes that extend well beyond the concentration of IPMP.

The Multidimensional Chromatography (MDC) Workshop
 

Related content

An advanced integrated GC-MS/MS and LC-MS/MS workflow for the comprehensive analysis of pesticide residues in food

Applications
| 2024 | Thermo Fisher Scientific
Instrumentation
GC/MSD, GC/MS/MS, GC/QQQ, LC/MS, LC/MS/MS, LC/QQQ
Manufacturer
Thermo Fisher Scientific
Industries
Food & Agriculture

Utilizing hyphenated EC-Raman to study a model system

Applications
| 2024 | Metrohm
Instrumentation
RAMAN Spectroscopy
Manufacturer
Metrohm
Industries
Energy & Chemicals

Downstream Petrochemical Processes - Application Compendium

Guides
| 2024 | Agilent Technologies
Instrumentation
GC
Manufacturer
Agilent Technologies
Industries
Energy & Chemicals

Analysis of VOC and SVOC Emissions from Automotive Interior Materials Using GCMS-QP2050 in Accordance with VDA 278

Applications
| 2024 | Shimadzu
Instrumentation
Thermal desorption, GC/MSD, GC/SQ
Manufacturer
Shimadzu
Industries
Materials Testing

OMNIS NIRS

Brochures and specifications
| 2024 | Metrohm
Instrumentation
NIR Spectroscopy, Software
Manufacturer
Metrohm
Industries
Others
 

Related articles


Article | Upcoming events

Cal State LA hosts 15th Multidimensional Chromatography Workshop

This January, Cal State LA became a hub for scientists and researchers as it hosted the 15th Multidimensional Chromatography Workshop.
Complex Chemical Composition Analysis Lab (C³AL)
more

Article | Scientists

“Fat can be extracted even from thousand-year-old pottery,” says V. Brychová

Veronika Brychová finds herself peering into the culinary habits of ancient peoples through shards of prehistoric pottery, using fat residues to uncover what our ancestors cooked – and when.
Akademie věd České republiky
more

Article | Various

IOCB Prague opens branch in Boston, USA, prepares to make progress in cancer research

IOCB Prague has founded a new branch in Boston, USA, the very heart of global biomedical research.
Ústav organické chemie a biochemie AV ČR
more

Article | Scientists

TRIO OF UTA CHEMISTS RECOGNIZED AS LEADING LIGHTS

Three chemists from The University of Texas at Arlington are among the most influential analytical scientists in the world, as selected by a top publication.
The University of Texas at Arlington
more
 

Related content

An advanced integrated GC-MS/MS and LC-MS/MS workflow for the comprehensive analysis of pesticide residues in food

Applications
| 2024 | Thermo Fisher Scientific
Instrumentation
GC/MSD, GC/MS/MS, GC/QQQ, LC/MS, LC/MS/MS, LC/QQQ
Manufacturer
Thermo Fisher Scientific
Industries
Food & Agriculture

Utilizing hyphenated EC-Raman to study a model system

Applications
| 2024 | Metrohm
Instrumentation
RAMAN Spectroscopy
Manufacturer
Metrohm
Industries
Energy & Chemicals

Downstream Petrochemical Processes - Application Compendium

Guides
| 2024 | Agilent Technologies
Instrumentation
GC
Manufacturer
Agilent Technologies
Industries
Energy & Chemicals

Analysis of VOC and SVOC Emissions from Automotive Interior Materials Using GCMS-QP2050 in Accordance with VDA 278

Applications
| 2024 | Shimadzu
Instrumentation
Thermal desorption, GC/MSD, GC/SQ
Manufacturer
Shimadzu
Industries
Materials Testing

OMNIS NIRS

Brochures and specifications
| 2024 | Metrohm
Instrumentation
NIR Spectroscopy, Software
Manufacturer
Metrohm
Industries
Others
 

Related articles


Article | Upcoming events

Cal State LA hosts 15th Multidimensional Chromatography Workshop

This January, Cal State LA became a hub for scientists and researchers as it hosted the 15th Multidimensional Chromatography Workshop.
Complex Chemical Composition Analysis Lab (C³AL)
more

Article | Scientists

“Fat can be extracted even from thousand-year-old pottery,” says V. Brychová

Veronika Brychová finds herself peering into the culinary habits of ancient peoples through shards of prehistoric pottery, using fat residues to uncover what our ancestors cooked – and when.
Akademie věd České republiky
more

Article | Various

IOCB Prague opens branch in Boston, USA, prepares to make progress in cancer research

IOCB Prague has founded a new branch in Boston, USA, the very heart of global biomedical research.
Ústav organické chemie a biochemie AV ČR
more

Article | Scientists

TRIO OF UTA CHEMISTS RECOGNIZED AS LEADING LIGHTS

Three chemists from The University of Texas at Arlington are among the most influential analytical scientists in the world, as selected by a top publication.
The University of Texas at Arlington
more
 

Related content

An advanced integrated GC-MS/MS and LC-MS/MS workflow for the comprehensive analysis of pesticide residues in food

Applications
| 2024 | Thermo Fisher Scientific
Instrumentation
GC/MSD, GC/MS/MS, GC/QQQ, LC/MS, LC/MS/MS, LC/QQQ
Manufacturer
Thermo Fisher Scientific
Industries
Food & Agriculture

Utilizing hyphenated EC-Raman to study a model system

Applications
| 2024 | Metrohm
Instrumentation
RAMAN Spectroscopy
Manufacturer
Metrohm
Industries
Energy & Chemicals

Downstream Petrochemical Processes - Application Compendium

Guides
| 2024 | Agilent Technologies
Instrumentation
GC
Manufacturer
Agilent Technologies
Industries
Energy & Chemicals

Analysis of VOC and SVOC Emissions from Automotive Interior Materials Using GCMS-QP2050 in Accordance with VDA 278

Applications
| 2024 | Shimadzu
Instrumentation
Thermal desorption, GC/MSD, GC/SQ
Manufacturer
Shimadzu
Industries
Materials Testing

OMNIS NIRS

Brochures and specifications
| 2024 | Metrohm
Instrumentation
NIR Spectroscopy, Software
Manufacturer
Metrohm
Industries
Others
 

Related articles


Article | Upcoming events

Cal State LA hosts 15th Multidimensional Chromatography Workshop

This January, Cal State LA became a hub for scientists and researchers as it hosted the 15th Multidimensional Chromatography Workshop.
Complex Chemical Composition Analysis Lab (C³AL)
more

Article | Scientists

“Fat can be extracted even from thousand-year-old pottery,” says V. Brychová

Veronika Brychová finds herself peering into the culinary habits of ancient peoples through shards of prehistoric pottery, using fat residues to uncover what our ancestors cooked – and when.
Akademie věd České republiky
more

Article | Various

IOCB Prague opens branch in Boston, USA, prepares to make progress in cancer research

IOCB Prague has founded a new branch in Boston, USA, the very heart of global biomedical research.
Ústav organické chemie a biochemie AV ČR
more

Article | Scientists

TRIO OF UTA CHEMISTS RECOGNIZED AS LEADING LIGHTS

Three chemists from The University of Texas at Arlington are among the most influential analytical scientists in the world, as selected by a top publication.
The University of Texas at Arlington
more
 

Related content

An advanced integrated GC-MS/MS and LC-MS/MS workflow for the comprehensive analysis of pesticide residues in food

Applications
| 2024 | Thermo Fisher Scientific
Instrumentation
GC/MSD, GC/MS/MS, GC/QQQ, LC/MS, LC/MS/MS, LC/QQQ
Manufacturer
Thermo Fisher Scientific
Industries
Food & Agriculture

Utilizing hyphenated EC-Raman to study a model system

Applications
| 2024 | Metrohm
Instrumentation
RAMAN Spectroscopy
Manufacturer
Metrohm
Industries
Energy & Chemicals

Downstream Petrochemical Processes - Application Compendium

Guides
| 2024 | Agilent Technologies
Instrumentation
GC
Manufacturer
Agilent Technologies
Industries
Energy & Chemicals

Analysis of VOC and SVOC Emissions from Automotive Interior Materials Using GCMS-QP2050 in Accordance with VDA 278

Applications
| 2024 | Shimadzu
Instrumentation
Thermal desorption, GC/MSD, GC/SQ
Manufacturer
Shimadzu
Industries
Materials Testing

OMNIS NIRS

Brochures and specifications
| 2024 | Metrohm
Instrumentation
NIR Spectroscopy, Software
Manufacturer
Metrohm
Industries
Others
 

Related articles


Article | Upcoming events

Cal State LA hosts 15th Multidimensional Chromatography Workshop

This January, Cal State LA became a hub for scientists and researchers as it hosted the 15th Multidimensional Chromatography Workshop.
Complex Chemical Composition Analysis Lab (C³AL)
more

Article | Scientists

“Fat can be extracted even from thousand-year-old pottery,” says V. Brychová

Veronika Brychová finds herself peering into the culinary habits of ancient peoples through shards of prehistoric pottery, using fat residues to uncover what our ancestors cooked – and when.
Akademie věd České republiky
more

Article | Various

IOCB Prague opens branch in Boston, USA, prepares to make progress in cancer research

IOCB Prague has founded a new branch in Boston, USA, the very heart of global biomedical research.
Ústav organické chemie a biochemie AV ČR
more

Article | Scientists

TRIO OF UTA CHEMISTS RECOGNIZED AS LEADING LIGHTS

Three chemists from The University of Texas at Arlington are among the most influential analytical scientists in the world, as selected by a top publication.
The University of Texas at Arlington
more
Other projects
Follow us
More information
WebinarsAbout usContact usTerms of use
LabRulez s.r.o. All rights reserved. Content available under a CC BY-SA 4.0 Attribution-ShareAlike