Agilent Mass Profiler GC/MS · Agilent Mass Profiler GC/MS Agilent Mass Profiler Mass Profiler Key...

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Agilent Mass Profiler GC/MS Agilent Mass Profiler Mass Profiler Key word Mass Profiler Authors

Transcript of Agilent Mass Profiler GC/MS · Agilent Mass Profiler GC/MS Agilent Mass Profiler Mass Profiler Key...

Page 1: Agilent Mass Profiler GC/MS · Agilent Mass Profiler GC/MS Agilent Mass Profiler Mass Profiler Key word Mass Profiler Authors . 2 1. GC/MS MassHunter Molecular Feature Extraction

Agilent Mass Profiler

GC/MS

Agilent Mass Profiler

Mass Profiler

Key word Mass Profiler

Authors

Page 2: Agilent Mass Profiler GC/MS · Agilent Mass Profiler GC/MS Agilent Mass Profiler Mass Profiler Key word Mass Profiler Authors . 2 1. GC/MS MassHunter Molecular Feature Extraction

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1.

GC/MS

MassHunter

Molecular Feature

Extraction MFE

Agilent Mass Profiler

Mass Profiler 2

Mass Profiler

2.

:1 ml 5 /10ml

Sequential 1 +1 30%

GC/MS

: HP-INNOWax 30 m,0.25 mm,0.25 m

:40 (2 min)-3 /min-240 (11.333 min)

SPME

DVB/Carboxen/PDMS 2 cm

:60 30 min

:10 ml 3 g /20 ml

GC/MS

: HP-5ms 30 m,0.25 mm,0.25 m

:40 (3 min)-10 /min-280 (5 min)

: 2 min

:270

:1.2 ml/min

3.Mass Profiler

Mass Profiler

GC/MS

Mass Hunter

Unknowns Analysis

.cef 1

Feature Finding Peak

Alignment Stastics Analysis

2 3

ID Browser

1

Page 3: Agilent Mass Profiler GC/MS · Agilent Mass Profiler GC/MS Agilent Mass Profiler Mass Profiler Key word Mass Profiler Authors . 2 1. GC/MS MassHunter Molecular Feature Extraction

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2

3 ID Browser

4.

5 2 Japanese

Islay Differential Score>=95

Japanese Single Malt Whisky

Islay

Single Malt Whisky

ppm

5

6

157

2,5-

ID#58 Islay Single Malt

Whisky

Page 4: Agilent Mass Profiler GC/MS · Agilent Mass Profiler GC/MS Agilent Mass Profiler Mass Profiler Key word Mass Profiler Authors . 2 1. GC/MS MassHunter Molecular Feature Extraction

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6

7 157

Islay Single Malt Whisky 3

Japanese Single Malt Whisky 3

Islay Single Malt Whisky

7 157

8 PCA

1 93.68%

2

C-C

C-C

covariance ( correlation( )

) Islay

Single Malt Whisky

Japanese Single Malt Whisky

Islay Single Malt Whisky

8 PCA

9

1

2- 2,4- 2,6-

2,4,6-

1 ppb 2,4,6- 10

ppt TICC

MassProfiler Feature Finding

スコアプロット

C-C

プロット

寄与率

Page 5: Agilent Mass Profiler GC/MS · Agilent Mass Profiler GC/MS Agilent Mass Profiler Mass Profiler Key word Mass Profiler Authors . 2 1. GC/MS MassHunter Molecular Feature Extraction

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Mass Profiler

TICC

www.agilent.com/chem/jp

0120-477-111

[email protected]

© Agilent Technologies, Inc. 2018

Printed in Japan, October 22, 2018

GC-MS-201810NK-001