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Tomato Day 4 storage 4C

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Jane Parker

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Tomato Day 4 storage 4C

Project Tomato Storage

Date of collection 2017-03-20

Citation MSc Thesis 2017 Artem Trufanov

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 5g

Sample storage before sampling? No

Material state Chopped

Suppressing enzyme-driven changes Yes

Solution The fruit were taken off the scale and blended for 30 s, stopped for 90 s (to allow some initial enzyme activity during this time). After blending part a saturated CaCl2 solution (80g CaCl2 / 100 g water) added to the homogenate enzymes; with proportion 1

Increase headspace sensitivity (“salting out”) No

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation Yes

What platform? CombiPal

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 37°C

Headspace equilibrium time 10min

Extraction mode Yes

Extraction time 15min

Extraction temperature 37°C

Desorption time 10min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type Zebron DB5 MSi

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 5min

GC first temperature ramp rate 6°C/min

GC final temperature 260°C

GC final temperature hold time 0 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 5.2Hz

Ionisation -70eV

Tomato Day 4 storage 10C

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Jane Parker

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Tomato Day 4 storage 10C

Project Tomato Storage

Date of collection 2017-03-20

Citation MSc Thesis 2017 Artem Trufanov

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 5g

Sample storage before sampling? No

Material state Chopped

Suppressing enzyme-driven changes Yes

Increase headspace sensitivity (“salting out”) No

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation Yes

What platform? CombiPal

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 37°C

Headspace equilibrium time 10min

Extraction mode Yes

Extraction time 15min

Extraction temperature 37°C

Desorption time 10min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type Zebron DB5 MSi

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 5min

GC first temperature ramp rate 6°C/min

GC final temperature 260°C

GC final temperature hold time 0 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 5.2Hz

Ionisation -70eV

Tomato Day 0

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Jane Parker

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Tomato Day 0

Project Tomato Storage

Date of collection 2017-03-16

Citation MSc Thesis 2017 Artem Trufanov

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 5g

Sample storage before sampling? No

Material state Chopped

Suppressing enzyme-driven changes Yes

Increase headspace sensitivity (“salting out”) Yes

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation Yes

What platform? CombiPal

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 37°C

Headspace equilibrium time 10min

Extraction mode Yes

Extraction time 15min

Extraction temperature 37°C

Desorption time 10min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type Zebron DB5 MSi

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 5min

GC first temperature ramp rate 6°C/min

GC final temperature 260°C

GC final temperature hold time 0 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 5.2Hz

Ionisation -70eV

Vanilla syrup

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Heather Spooner

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Vanilla syrup

Project Parosmia Project

Date of collection 2022-03-21

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 1g

Sample storage before sampling? Yes

Sample storage temperature before sampling 4°C

Material state syrup

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation No

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 40°C

Headspace equilibrium time 20min

Extraction mode Yes

Extraction time 20min

Extraction temperature 40°C

Desorption time 20min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type HP-5 5% Phenyl Methyl Siloxan

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 2min

GC first temperature ramp rate 4°C/min

GC final temperature 250°C

GC final temperature hold time 8 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 0.69Hz

Ionisation -70eV

Hazelnut syrup

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Heather Spooner

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Hazelnut syrup

Project Parosmia Project

Date of collection 2022-03-21

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 1g

Sample storage before sampling? Yes

Sample storage temperature before sampling 4°C

Material state syrup

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation No

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 40°C

Headspace equilibrium time 20min

Extraction mode Yes

Extraction time 20min

Extraction temperature 40°C

Desorption time 20min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type HP-5 5% Phenyl Methyl Siloxan

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 2min

GC first temperature ramp rate 4°C/min

GC final temperature 250°C

GC final temperature hold time 8 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 0.69Hz

Ionisation -70eV

Gingerbread syrup

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Heather Spooner

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Gingerbread syrup

Project Parosmia Project

Date of collection 2022-03-21

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 1g

Sample storage before sampling? Yes

Sample storage temperature before sampling 4°C

Material state syrup

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation No

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 40°C

Headspace equilibrium time 20min

Extraction mode Yes

Extraction time 20min

Extraction temperature 40°C

Desorption time 20min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type HP-5 5% Phenyl Methyl Siloxan

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 2min

GC first temperature ramp rate 4°C/min

GC final temperature 250°C

GC final temperature hold time 8 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 0.69Hz

Ionisation -70eV

Caramel syrup

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Heather Spooner

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Caramel syrup

Project Parosmia Project

Date of collection 2022-03-21

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 1g

Sample storage before sampling? Yes

Sample storage temperature before sampling 4°C

Material state syrup

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation No

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 40°C

Headspace equilibrium time 20min

Extraction mode Yes

Extraction time 20min

Extraction temperature 40°C

Desorption time 20min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type HP-5 5% Phenyl Methyl Siloxan

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 2min

GC first temperature ramp rate 4°C/min

GC final temperature 250°C

GC final temperature hold time 8 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 0.69Hz

Ionisation -70eV

Amaretto syrup

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Heather Spooner

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Amaretto syrup

Project Parosmia Project

Date of collection 2022-03-21

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 1g

Sample storage before sampling? Yes

Sample storage temperature before sampling 4°C

Material state syrup

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation No

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 40°C

Headspace equilibrium time 20min

Extraction mode Yes

Extraction time 20min

Extraction temperature 40°C

Desorption time 20min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type HP-5 5% Phenyl Methyl Siloxan

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 2min

GC first temperature ramp rate 4°C/min

GC final temperature 250°C

GC final temperature hold time 8 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 0.69Hz

Ionisation -70eV

Washing up liquid

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Heather Spooner

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Washing up liquid

Project Parosmia Project

Date of collection 2022-10-13

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 1g

Sample storage before sampling? Yes

Sample storage temperature before sampling 4°C

Material state liquid

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation No

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 55°C

Headspace equilibrium time 20min

Extraction mode Yes

Extraction time 20min

Extraction temperature 55°C

Desorption time 20min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type HP-5 5% Phenyl Methyl Siloxan

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 2min

GC first temperature ramp rate 4°C/min

GC final temperature 250°C

GC final temperature hold time 6 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 0.69Hz

Ionisation -70eV

Shampoo

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Heather Spooner

University of Reading, Reading, Berkshire, United Kingdom

Department of Food and Nutritional Sciences

Sample in glass vial

18ml

Solid-Phase Microextraction (SPME)

Sample details

Title Shampoo

Project Parosmia Project

Date of collection 2022-10-13

Collection method Sample in glass vial

Collection volume (of the vial) 18ml

Did not weight No

Mass of object sample 1g

Sample storage before sampling? Yes

Sample storage temperature before sampling 4°C

Material state liquid

Sampling method

Sampling method Solid-Phase Microextraction (SPME)

Robotic automation No

Sorbent type triple phase DVB/Carboxen/PDMS 1 cm
DVB 50 um Carboxen 30 um PDMS 30 um

Sorbent phase thickness 30um

Headspace equilibrium temperature 55°C

Headspace equilibrium time 20min

Extraction mode Yes

Extraction time 20min

Extraction temperature 55°C

Desorption time 20min

Desorption temperature 250°C

Vortex Yes

Vortex speed 500rpm

GC-MS

Column type HP-5 5% Phenyl Methyl Siloxan

Column constant flow 0.9ml/min

Length 30m

Inner diameter 0.25mm

Film thickness 1μm

Carrier gas He

Temperature ramps

Number of ramps 1

GC initial temperature 40°C

GC initial temperature hold time 2min

GC first temperature ramp rate 4°C/min

GC final temperature 250°C

GC final temperature hold time 6 min

Mass Spectrometer detectors Quadrupole MS 5975C (Agilent)

Scan mass range 20-280

Data rate 0.69Hz

Ionisation -70eV

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