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Clustering data with hclust algorithm for (Study ST000603)
(Analysis AN000923)
Metabolite
Structure
F1
F2
Benzene, (1-methylethyl)-
ME171169
0.88
1.15
benzoylformic acid
ME171176
0.80
1.13
Ethylbenzene
ME171151
0.82
1.18
o-Xylene
ME171153
0.82
1.18
2,4,6-Octatrienal
ME171186
0.66
1.17
4-Carene, (1S,3R,6R)-(-)-
ME171182
0.70
1.30
5-Methyl-1-heptanol
ME171188
0.71
1.29
Acetophenone
ME171170
0.72
1.24
4-pentenal, 2-methyl
ME171167
0.75
1.25
Benzene, 1,3-bis(1,1-dimethylethyl)-
ME171149
0.73
1.27
Benzene, chloro-
ME171177
1.02
0.97
Allyl Isothiocyanate
ME171160
1.05
0.96
Methyl Isobutyl Ketone
ME171171
1.03
0.95
Amylene Hydrate
ME171183
1.12
0.92
Pyrrole
ME171166
1.08
0.93
2-Heptanone
ME171145
1.09
0.91
4-Heptanone
ME171146
1.10
0.90
Benzoic acid, 2-[(trimethylsilyl)oxy]-, trimethylsilyl ester
ME171150
0.91
1.09
2-Heptanone, 4-methyl-
ME171144
0.92
1.08
Benzene, (2-isothiocyanatoethyl)-
ME171175
0.93
1.08
2-Heptanone, 4,6-dimethyl-
ME171143
0.96
1.04
Hexane
ME171162
0.99
1.01
toluene
ME171157
0.98
1.02
Hexaethylene glycol dimethyl ether
ME171152
0.98
1.02
styrene
ME171154
0.98
1.02
Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1à,2á,5à)-(ñ)-
ME171161
1.28
0.69
t-Butyl ethyl ether2
ME171155
1.31
0.72
Benzene, (1-methyl-1-butenyl)-
ME171174
1.18
0.76
Benzaldehyde, 4-methyl-
ME171147
1.23
0.77
Phenol, 2,4-bis(1,1-dimethylethyl)-
ME171163
1.22
0.75
Thiocyanic acid, 2-propenyl ester
ME171156
1.18
0.84
2-Propanol, 2-methyl-
ME171159
1.22
0.81
Propylamine
ME171165
1.22
0.81
2-Pentanone
ME171158
1.41
0.59
Cyclopropane, isothiocyanato-
ME171179
1.58
0.77
Phenol
ME171164
1.45
0.75
Benzaldehyde
ME171148
1.58
0.42
Propofol
ME171189
1.22
0.34
Cyclohexanone
ME171178
0.07
1.19
Benzaldehyde, 2,5-dimethyl-
ME171184
NA
1.00
2-Propenoic acid, 2-methyl-, 1,2-ethanediyl ester
ME171181
NA
1.00
1-Octanol
ME171185
NA
1.00
2-Cyclohexen-1-one, 3,5,5-trimethyl-
ME171187
NA
1.00
2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (S)-
ME171173
0.57
1.51
Benzaldehyde, 3,5-dimethyl-
ME171168
0.49
1.51
1-Hexanol, 2-ethyl-
ME171172
0.30
1.94
2-Cyclohexen-1-one, 3-methyl-6-(1-methylethyl)-
ME171180
0.20
2.00
Factors:
F1
Treatment:control
F2
Treatment:IC
Data matrix
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