Compound | Class/subclass Alkaloid family | Rt (min) | Replicate | BF | |||
---|---|---|---|---|---|---|---|
1 | 2 | 3 | 4 | ||||
3-methylpentane | Alkanes | 2.27 | 705,879 | Â | 1,124,419 | Â | nd |
3-methylbutan-1-ol | Alcohols and polyols | 4.47 | 372,701 | 314,028 | 1,120,769 | 924,992 | D 2 |
hexanal | Carbonyl compounds | 6.05 | 214,369 | 319,896 | 360,387 | 235,433 | D 2 |
2,4,6-trimethylpyridine | Methylpyridines | 11.52 | 1,075,816 | 742,879 | 514,956 | 1,386,495 | nd |
2-ethylhexan-1-ol | Fatty alcohols | 12.57 | 926,002 | 504,742 | 387,674 | 353,196 | nd |
N,N-dimethyl-1-phenylmethanamine | Phenylmethylamines | 12.89 | 1,372,753 | 718,613 | 1,524,860 | 6,240,599 | nd |
octan-1-ol | Fatty alcohols | 13.72 | Â | 166,013 | Â | Â | R 2 |
nonanal | Carbonyl compounds | 14.65 | 443,257 | 1,896,061 | 1,554,323 | 1,845,908 | nd |
1,2-dimethoxybenzene | Methoxybenzenes | 15.85 | 616,333 | Â | Â | 545,145 | D 2 |
nonan-1-ol | Fatty alcohols | 16.61 | Â | 193,102 | 117,130 | Â | nd |
167E | 3,5-I | 17.43 | Â | Â | Â | 305,129 | t B* 1 |
decanal | Carbonyl compounds | 17.63 | 278,696 | 700,648 | 1,604,149 | 1,134,669 | D 2 |
1,2-benzothiazole | Benzothiazoles | 18.25 | 144,183 | 74,430 | 800,979 | 136,283 | nd |
Unknown1 |  | 18.55 |  |  |  | 75,485 | – |
3,5-dimethyl-2-(2-methylbutyl)pyrazine | Pyrazines | 18.61 | 4,599,780 | 276,403 | 322,721 | Â | DP 1 |
Unknown2 |  | 18.92 | 8,629,722 |  |  |  | – |
Unknown3 |  | 19.18 | 31,992,502 |  | 667,980 |  | – |
Unknown4 |  | 19.86 | 1,087,042 |  |  |  | – |
1,2,2-triethylpyrrolidine | N-alkylpyrrolidines | 20.01 | Â | Â | 229,410 | Â | R 1 |
Unknown5 |  | 20.49 |  | 213,285 |  |  | – |
207I | 1,4-Q | 20.59 | 511,736 | Â | Â | Â | B* 1 |
(3-hydroxy-2,4,4-trimethylpentyl) 2-methylpropanoate | Carboxylic acid derivatives | 22.79 | 463,512 | 1,601,188 | 1,534,685 | 1,913,640 | nd |
277E | 5,6,8-I | 23.09 | 659,662 | Â | 515,089 | 149,741 | B* 1 |
4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-one | Sesquiterpenoids | 24.77 | 499,394 | 178,155 | 394,571 | 620,594 | nd |
(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one | Sesquiterpenoids | 26.18 | 298,444 | 231,400 | 597,650 | 1,081,089 | nd |
223AB (5E,9Z) | 3,5-I | 27.08 | 3,807,696 | Â | Â | 8,685,370 | t B* 1 |
223AB (5E,9E) | 3,5-I | 27.49 | 264,366 | Â | Â | 618,971 | t B* 1 |
223AB (5Z,9Z) | 3,5-I | 27.96 | 650,603 | Â | Â | 1,623,468 | t B* 1 |
Unknown6 |  | 28.52 |  | 536,527 |  | 556,661 | – |
tetradecanal | Fatty aldehydes | 29.76 | Â | 460,880 | Â | Â | R 2 |
Unknown7 |  | 30.24 | 443,555 | 387,061 | 427,026 | 783,730 | – |
N-butyl-N-(2-oxochromen-3-yl)acetamide | Coumarins and derivatives | 31.02 | 864,020 | Â | Â | 2,087,588 | nd |
3-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one | Sesquiterpenoids | 31.34 | 403,695 | 212,268 | 398,450 | 789,925 | nd |