Processed databases
Atom-Mass pairs
Outputs for Metoclopramide; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
Database: Department of Environmental Chemistry, Eawag
Entry ID: EA278112
Synonyms: Metoclopramide, 4-amino-5-chloro-N-(2-diethylaminoethyl)-2-methoxy-benzamide
Total mass: 299.7955
Formula: H22 C14 N3 O2 Cl1
Experimental information
MS type: MS2
Instrument: LTQ Orbitrap XL Thermo Scientific
Instrument type: LC-ESI-ITFT
Ionization: ESI
Ionization mode: POSITIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 92.0494, 100.1121, 128.0262, 148.063, 156.0211, 168.9925, 170.0003, 183.032, 184.016, 212.0347,
Processing time: 0:00:03.326319
Results for the quried mass "93.0573"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C5N1O1 | 0.026 | 3 | 0 | C6,C7,C10,C13,C14,N17,O20 |
| C5N1O1 | 0.026 | 3 | 0 | C6,C8,C10,C11,C14,N17,O19 |
| C5N1O1 | 0.026 | 3 | 0 | C6,C8,C10,C13,C14,N17,O20 |
| C5N1O1 | 0.026 | 3 | 0 | C6,C9,C10,C13,C14,N17,O20 |
| C5N1O1 | 0.026 | 3 | 0 | C6,C9,C10,C13,C14,N17,O19 |
| C5N1O1 | 0.026 | 3 | 0 | C6,C7,C8,C10,C14,N17,O19 |
| C5N1O1 | 0.026 | 3 | 0 | C6,C7,C10,C13,C14,N17,O19 |
| C5N1O1 | 0.026 | 3 | 0 | C6,C8,C10,C13,C14,N17,O19 |
| C5N1O1 | 0.026 | 3 | 0 | C8,C9,C10,C12,C13,N16,O20 |
| C5N1O1 | 0.026 | 3 | 0 | C8,C9,C11,C12,C13,N16,O20 |
| C5N1O1 | 0.026 | 3 | 0 | C8,C10,C11,C12,C13,N16,O20 |
| C5N1O1 | 0.026 | 3 | 0 | C8,C10,C11,C12,C14,N16,O19 |
| C5N1O1 | 0.026 | 3 | 1 | C8,C9,C10,C13,C14,N17,O20 |
| C5N1O1 | 0.026 | 3 | 0 | C8,C9,C10,C13,C14,N17,O19 |
| C5N1O1 | 0.026 | 3 | 1 | C8,C10,C11,C12,C14,N17,O19 |
| C5N1O1 | 0.026 | 3 | 2 | C8,C10,C11,C13,C14,N17,O20 |
| C5N1O1 | 0.026 | 3 | 1 | C8,C10,C11,C13,C14,N17,O19 |
| C5N1O1 | 0.026 | 3 | 0 | C9,C10,C12,C13,C14,N16,O19 |
| C5N1O1 | 0.026 | 3 | 0 | C9,C10,C12,C13,C14,N16,O20 |
| C5N1O1 | 0.026 | 3 | 1 | C9,C10,C12,C13,C14,N17,O19 |
| C5N1O1 | 0.026 | 3 | 2 | C9,C10,C12,C13,C14,N17,O20 |
| C5N1O1 | 0.026 | 3 | 0 | C9,C10,C11,C12,C13,N16,O20 |
| C6O1 | 0.046 | 5 | 2 | C8,C9,C10,C12,C13,C14,O19 |
| C6O1 | 0.046 | 5 | 2 | C8,C9,C10,C11,C12,C14,O19 |
| C6O1 | 0.046 | 5 | 2 | C8,C9,C10,C11,C13,C14,O19 |
| C5O2 | 0.003 | 1 | 0 | C8,C9,C10,C13,C14,O19,O20 |
| C5O2 | 0.003 | 1 | 0 | C8,C10,C11,C13,C14,O19,O20 |
| C5O2 | 0.003 | 1 | 0 | C9,C10,C12,C13,C14,O19,O20 |
| C6N1 | 0.069 | 7 | 2 | C6,C7,C8,C10,C11,C14,N17 |
| C6N1 | 0.069 | 7 | 2 | C6,C7,C9,C10,C13,C14,N17 |
| C6N1 | 0.069 | 7 | 2 | C6,C7,C8,C10,C13,C14,N17 |
| C4N1O2 | 0.017 | 1 | 0 | C6,C10,C13,C14,N17,O19,O20 |
| C4N1O2 | 0.017 | 1 | 0 | C8,C10,C13,C14,N17,O19,O20 |
| C4N1O2 | 0.017 | 1 | 0 | C9,C10,C13,C14,N17,O19,O20 |
| C5N2 | 0.049 | 5 | 0 | C4,C6,C7,C10,C14,N17,N18 |
| C5N2 | 0.049 | 5 | 0 | C1,C4,C6,C7,C14,N17,N18 |
| C5N2 | 0.049 | 5 | 0 | C4,C5,C6,C7,C14,N17,N18 |
| C5N2 | 0.049 | 5 | 0 | C1,C4,C5,C6,C7,N17,N18 |
| C5N2 | 0.049 | 5 | 0 | C5,C6,C7,C10,C14,N17,N18 |
| C5N2 | 0.049 | 5 | 0 | C2,C5,C6,C7,C14,N17,N18 |
| C5N2 | 0.049 | 5 | 0 | C6,C7,C8,C10,C14,N17,N18 |
| C5N2 | 0.049 | 5 | 1 | C6,C7,C10,C13,C14,N17,N18 |
| C5N2 | 0.049 | 5 | 2 | C8,C10,C11,C12,C14,N16,N17 |
| C5N2 | 0.049 | 5 | 2 | C9,C10,C12,C13,C14,N16,N17 |
| C4N2O1 | 0.006 | 1 | 0 | C4,C6,C7,C14,N17,N18,O19 |
| C4N2O1 | 0.006 | 1 | 0 | C5,C6,C7,C14,N17,N18,O19 |
| C4N2O1 | 0.006 | 1 | 0 | C6,C7,C10,C14,N17,N18,O19 |