Processed databases
Atom-Mass pairs
Outputs for Triclosan; LC-ESI-QFT; MS2; CE: 150; R=35000; [M-H]-
Database: Department of Environmental Chemistry, Eawag
Entry ID: EQ016858
Synonyms: Triclosan, 5-chloro-2-(2,4-dichlorophenoxy)phenol
Total mass: 289.5415
Formula: H7 C12 O2 Cl3
Experimental information
MS type: MS2
Instrument: Q Exactive Plus Orbitrap Thermo Scientific
Instrument type: LC-ESI-QFT
Ionization: ESI
Ionization mode: NEGATIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks:
Processing time: 0:00:00.382449
Results for the quried mass "89.0033"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C5,C7,C9,C11,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C4,C6,C8,C10,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C4,C6,C8,C10,C12,O16 |
| C6O1 | 0.068 | 1 | 0 | C1,C2,C3,C4,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C6,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C5,C7,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C4,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C4,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C4,C7,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C5,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C9,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C7,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C5,C7,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C1,C3,C7,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C4,C5,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C6,C8,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C3,C4,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C3,C4,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C3,C4,C8,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C4,C6,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C4,C9,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C4,C8,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C4,C6,C8,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C2,C4,C8,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C3,C6,C8,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C3,C4,C5,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C3,C4,C6,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C3,C5,C7,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C3,C5,C9,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C3,C6,C9,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C4,C5,C7,C9,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C4,C5,C9,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C4,C6,C8,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C4,C6,C9,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C5,C6,C9,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C5,C7,C9,C10,C11,C12,O17 |
| C6O1 | 0.068 | 1 | 0 | C6,C8,C9,C10,C11,C12,O17 |
| C3O1Cl1 | 0.497 | 2 | 2 | C9,C11,C12,Cl15,O17 |
| C3O1Cl1 | 0.497 | 2 | 0 | C6,C8,C10,Cl14,O16 |
| C3O1Cl1 | 0.497 | 2 | 1 | C3,C9,C11,Cl15,O17 |
| C3O1Cl1 | 0.497 | 2 | 1 | C5,C9,C11,Cl15,O17 |