| Measured Mass (m/z) | Nitrogen Rule | No. of Nitrogen(s)* | Proposed Formula | Electron Paring | Calculated Mass (m/z) | Error** (ppm) |
| 386.0783 | ON | 3 | C16H15F3N3O3S+ | [M+H]+ | 386.0781 | 0.5 |
| 322.1168 | ON | 3 | C16H15F3N3O+ | EE | 322.1162 | 1.9 |
| 268.0260 | ON | 1 | C9H9F3NO3S+ | EE | 268.0250 | 3.7 |
| 222.0753 | ON | 1 | C9H11F3NO2+ | EE | 222.0736 | 7.7 |
| 220.0585 | ON | 1 | C9H9F3NO2+ | EE | 220.0580 | 2.3 |
| 205.0715 | ON | 1 | C9H10F3NO•+ | OE | 205.0709 | 2.9 |
| 204.0635 | ON | 1 | C9H9F3NO+ | EE | 204.0631 | 2.0 |
| 190.0475 | ON | 1 | C8H7F3NO+ | EE | 190.0474 | 0.5 |
| 136.0759 | ON | 1 | C8H10NO+ | EE | 136.0757 | 1.5 |
| 119.0605 | EN | 2 | C7H7N2+ | EE | 119.0604 | 0.8 |