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. 2023 Jun 1;9(6):e16866. doi: 10.1016/j.heliyon.2023.e16866
Compound Name Molecular weight Molecular formula Retention time ID number % Peak area Chemical structure
1 1,2- Cyclopentanedione 98 C5H6O2 6.959 60,722 0.83 Image 1
2 Pantolactone Or Pantothenic lactone 130 C6H10O3 10.665 8012 0.27 Image 2
3 Maltol 126 C6H6O3 11.303 17,332 0.25 Image 3
4 2(5H)-Furanone, 3-hydroxy-4,5-dimethyl 128 C6H8O3 11.93 45,390 0.07 Image 4
5 4H-Pyran-4-one,2,3-dihydro-3,5-dihydroxy-6-methyl 144 C6H8O4 12.885 1857 0.28 Image 5
6 Benzofuran,2,3-dihydro Or Coumaran 120 C8H8O 14.635 16,156 1.02 Image 6
7 2-Furancarboxaldehyde,5-(hydroxymethyl)- 126 C6H6O3 14.817 60,271 0.51 Image 7
8 Niacin 123 C6H5NO2 15.209 16,856 0.68 Image 8
9 Methyl 6-oxoheptanoate 158 C8H14O3 16.146 6770 0.35 Image 9
10 1-pyrrolid-2-one, N-carboxyhydrazide 143 C5H9N3O2 17.817 45,666 0.12 Image 10
11 N-[3-Hexylaminopropyl] aziridine 184 C11H24N2 18.248 14,285 0.47 Image 11
12 α-[2-[N-Aziridyl]ethylamino] isobutyronitrile 153 C8H15N3 18.498 4530 0.21 Image 12
13 2-Carboxymethyl-3-methyl-cyclopentanecarboxylic acid 186 C9H14O4 20.742 43,577 0.09 Image 13
14 Cyclohexane-propanoic acid,3,4-dihydroxy 188 C9H16O4 20.889 57,609 0.3 Image 14
15 α-d-Glucopyranoside,methyl 194 C7H14O6 22.935 27,200 52.53 Image 15
16 3-O-Methyl-d-glucose 194 C7H14O6 25.048 35,456 39.2 Image 16
17 n-Hexadecanoic acid 256 C16H32O2 27.204 8479 0.3 Image 17
18 Carbamic acid, [3-(triethoxysilyl)propyl]-, 5-methyl-2-(1-methylethyl)cyclohexylester 403 C20H41NO5Si 29.235 129,958 0.73 Image 18
19 9,12-Octadecadienoic acid (z,z) Or Linoleic acid 280 C18H32O2 30.678 7212 0.55 Image 19
20 Di-n-octyl phthalate 390 C24H38O4 49.537 19,967 0.32 Image 20
21 9-Octadecenamide, (Z)- Or Oleamide 281 C18H35NO 53.482 6574 0.07 Image 21
22 Methannone, bis[4-(dimethylamino)phenyl]- 268 C17H20N2O 54.233 290,948 0.39 Image 22
23 9,12-Octadecadienoic acid (z,z)-,2-hydroxy-1-(hydroxymethyl)ethyl ester 354 C21H38O4 55.68 28,833 0.12 Image 23
24 9,12,15-Octadecadienoic acid, 2-[(trimethylsilyl)-1-[[(trimethylsilyl)oxy]methyl]ethyl ester, (Z,Z,Z) 496 C27H52O4Si2 59.757 3312 0.1 Image 24
25 Androst-7-ene-6,17-dione,2,3,14-trihydroxy-, (2β,3β,5α) Or Rubrosterone 334 C19H26O5 62.298 5584 0.24 Image 25