TABLE 6.
No. | Metabolite | t R/min | Formula | m/z | Ion | VIP (>1) |
---|---|---|---|---|---|---|
1 | Oleamide | 26.098 | C18H35NO | 282.2717 | [M+H]+ | 30.4936 |
2 | Hexadecanamide | 25.11 | C16H33NO | 256.25601 | [M+H]+ | 15.4175 |
3 | Stearamide | 28.837 | C18H37NO | 284.28736 | [M+H]+ | 9.10991 |
4 | Acetyl-l-carnitine | 1.597 | C9H17NO4 | 204.11568 | [M+H]+ | 5.74342 |
5 | 2-Oxoglutaric acid | 1.6 | C5H6O5 | 145.02105 | [M−H]− | 3.69693 |
6 | Isocitric acid | 1.582 | C6H8O7 | 191.02656 | [M−H]− | 3.43281 |
7 | dl-Tryptophan | 5.783 | C11H12N2O2 | 205.08979 | [M+H]+ | 4.79669 |
8 | Isoleucine | 1.604 | C6H13NO2 | 132.09464 | [M+H]+ | 3.60728 |
9 | Creatine | 1.351 | C4H9N3O2 | 132.06951 | [M+H]+ | 2.98949 |
10 | Acetyl-β-methylcholine | 1.576 | C8H17NO2 | 160.12585 | [M+H]+ | 3.80388 |
11 | l-Phenylalanine | 1.656 | C9H11NO2 | 166.07894 | [M+H]+ | 2.81315 |
12 | Valine | 1.591 | C5H11NO2 | 116.07912 | [M−H]− | 2.72165 |
13 | Citric acid | 2.349 | C6H8O7 | 191.02668 | [M−H]− | 3.69294 |
14 | dl-Carnitine | 1.313 | C7H15NO3 | 162.10514 | [M+H]+ | 1.71998 |
15 | N,N-Dimethylsphingosine | 29.381 | C20H41NO2 | 328.50292 | [M+H]+ | 2.51312 |
16 | Betaine | 1.287 | C5H11NO2 | 118.07911 | [M+H]+ | 2.34196 |
17 | Butyryl-l-carnitine | 5.743 | C11H21NO4 | 232.14691 | [M+H]+ | 1.48593 |
18 | Methionine | 1.602 | C5H11NO2S | 150.051 | [M+H]+ | 2.19918 |
19 | Palmitoylcarnitine | 18.383 | C23H45NO4 | 400.33466 | [M+H]+ | 1.54599 |
20 | Proline | 1.358 | C5H9NO2 | 116.0635 | [M+H]+ | 1.5666 |
21 | Choline | 1.259 | C5H13NO | 104.09999 | [M+H]+ | 1.24409 |
22 | l-γ-Glutamyl-l-leucine | 5.773 | C11H20N2O5 | 259.13695 | [M−H]− | 1.42737 |
23 | d-(+)-Malic acid | 1.56 | C4H6O5 | 133.02075 | [M−H]− | 1.4384 |
24 | 2-Hydroxyphenylalanine | 3.135 | C9H11NO3 | 182.07381 | [M+H]+ | 1.16375 |
25 | 6-Methylquinoline | 5.789 | C10H9N | 144.07345 | [M+H]+ | 1.31423 |
26 | Indole | 5.777 | C8H7N | 118.05792 | [M+H]+ | 1.42674 |
27 | Acetylcholine | 1.38 | C7H15NO2 | 146.11026 | [M+H]+ | 1.48906 |
28 | Propionylcarnitine | 1.619 | C10H19NO4 | 218.13125 | [M+H]+ | 1.05437 |
29 | Hexanoylcarnitine | 6.526 | C13H25NO4 | 260.17825 | [M+H]+ | 1.11086 |