Rank | ID | Average observed mass (m/z) | Theoretical mass (m/z) | Ion formula | AUC (95% CI)* |
---|---|---|---|---|---|
ADC | |||||
1 | 944 | 730.5379 | 730.5381 | C40 H77 O8 N1 P1+ | 0.655 (0.427—0.882) |
2 | 1737 | 761.5338 | 761.5338 | C41 H78 O10 N0 P1− | 0.612 (0.374—0.850) |
SQCC | |||||
1 | 1033 | 736.5285 | 736.5276 | C42 H75 O7 N1 P1+ | 0.733 (0.490—0.976) |
2 | 347 | 682.5405 | 682.5405 | C43 H72 O5 N1+ | 0.700 (0.419—0.981) |
3 | 2236 | 838.8222 | 838.8222 | C53 H108 O5 N1+ | 0.617 (0.333—0.901) |
4 | 1832 | 821.5550 | 821.5549 | C43 H82 O12 N0 P1− | 0.617 (0.301—0.932) |
5 | 2277 | 894.8485 | 894.8484 | C56 H112 O6 N1+ | 0.583 (0.167—0.999) |
6 | 2222 | 808.7753 | 808.7753 | C51 H102 O5 N1+ | 0.567 (0.220—0.913) |
7 | 2299 | 884.8066 | 884.8066 | C57 H106 O5 N1+ | 0.550 (0.230—0.870) |
8 | 20 | 440.3734 | 440.3734 | C26 H50 O4 N1+ | 0.533 (0.247—0.820) |
9 | 2219 | 810.7910 | 810.7909 | C51 H104 O5 N1+ | 0.533 (0.244—0.823) |
10 | 948 | 716.5590 | 716.5589 | C40 H79 O7 N1 P1+ | 0.500 (0.218—0.782) |
11 | 126 | 680.5835 | 680.5835 | C41 H78 O6 N1− | 0.433 (0.046—0.821) |
12 | 1722 | 735.5182 | 735.5182 | C39 H76 O10 N0 P1− | 0.417 (0.065—0.768) |