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Atom-Mass pairs
Submission id: EA278107

Outputs for Metoclopramide; LC-ESI-ITFT; MS2; CE: 90%; R=7500; [M+H]+


Database: Department of Environmental Chemistry, Eawag
Entry ID: EA278107
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: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 65.0385, 92.0493, 100.1121, 128.0261, 148.0631, 156.0211, 168.9925, 170.0003, 182.024, 183.032, 212.0346,
Processing time: 0:00:04.120395

Results for the quried mass "90.0338"

FormulaMass differencesNum. used protonsNum. required extra protonsAtom names
C5N2 0.049 2 0 C4,C6,C7,C10,C14,N17,N18
C5N2 0.049 2 0 C1,C4,C6,C7,C14,N17,N18
C5N2 0.049 2 0 C4,C5,C6,C7,C14,N17,N18
C5N2 0.049 2 0 C1,C4,C5,C6,C7,N17,N18
C5N2 0.049 2 0 C5,C6,C7,C10,C14,N17,N18
C5N2 0.049 2 0 C2,C5,C6,C7,C14,N17,N18
C5N2 0.049 2 0 C6,C7,C8,C10,C14,N17,N18
C5N2 0.049 2 0 C6,C7,C10,C13,C14,N17,N18
C5N2 0.049 2 0 C8,C10,C11,C12,C14,N16,N17
C5N2 0.049 2 0 C9,C10,C12,C13,C14,N16,N17
C5N1O1 0.026 0 0 C6,C7,C10,C13,C14,N17,O20
C5N1O1 0.026 0 0 C6,C8,C10,C11,C14,N17,O19
C5N1O1 0.026 0 0 C6,C8,C10,C13,C14,N17,O20
C5N1O1 0.026 0 0 C6,C9,C10,C13,C14,N17,O20
C5N1O1 0.026 0 0 C6,C9,C10,C13,C14,N17,O19
C5N1O1 0.026 0 0 C6,C7,C8,C10,C14,N17,O19
C5N1O1 0.026 0 0 C6,C7,C10,C13,C14,N17,O19
C5N1O1 0.026 0 0 C8,C9,C10,C12,C13,N16,O20
C5N1O1 0.026 0 0 C8,C9,C11,C12,C13,N16,O20
C5N1O1 0.026 0 0 C8,C10,C11,C12,C13,N16,O20
C5N1O1 0.026 0 0 C8,C10,C11,C12,C14,N16,O19
C5N1O1 0.026 0 0 C8,C9,C10,C13,C14,N17,O20
C5N1O1 0.026 0 0 C8,C10,C11,C13,C14,N17,O20
C5N1O1 0.026 0 0 C8,C9,C10,C13,C14,N17,O19
C5N1O1 0.026 0 0 C8,C10,C11,C12,C14,N17,O19
C5N1O1 0.026 0 0 C9,C10,C12,C13,C14,N16,O19
C5N1O1 0.026 0 0 C9,C10,C12,C13,C14,N16,O20
C5N1O1 0.026 0 0 C9,C10,C12,C13,C14,N17,O20
C5N1O1 0.026 0 0 C9,C10,C12,C13,C14,N17,O19
C5N1O1 0.026 0 0 C8,C10,C11,C13,C14,N17,O19
C3N1Cl1 0.497 5 2 C8,C11,C12,Cl15,N16
C3N1Cl1 0.497 5 2 C9,C11,C12,Cl15,N16
C6O1 0.046 2 0 C8,C9,C10,C11,C12,C13,O20
C6O1 0.046 2 0 C8,C9,C10,C12,C13,C14,O19
C6O1 0.046 2 0 C8,C9,C10,C11,C12,C14,O19
C6O1 0.046 2 0 C8,C9,C10,C11,C13,C14,O19
C6O1 0.046 2 0 C8,C10,C11,C12,C13,C14,O19
C6O1 0.046 2 1 C8,C10,C11,C12,C13,C14,O20
C6O1 0.046 2 0 C8,C9,C10,C12,C13,C14,O20
C6O1 0.046 2 0 C9,C10,C11,C12,C13,C14,O19
C6O1 0.046 2 0 C8,C9,C10,C11,C13,C14,O20
C6O1 0.046 2 1 C9,C10,C11,C12,C13,C14,O20
C6N1 0.069 4 1 C6,C9,C10,C12,C13,C14,N17
C6N1 0.069 4 1 C6,C8,C10,C11,C12,C14,N17
C6N1 0.069 4 0 C6,C7,C8,C10,C11,C14,N17
C6N1 0.069 4 0 C6,C7,C9,C10,C13,C14,N17
C6N1 0.069 4 1 C6,C8,C10,C11,C13,C14,N17
C6N1 0.069 4 0 C6,C8,C9,C10,C13,C14,N17
C6N1 0.069 4 0 C6,C7,C8,C10,C13,C14,N17
C6N1 0.069 4 0 C8,C9,C10,C11,C12,C13,N16
C6N1 0.069 4 2 C8,C9,C10,C12,C13,C14,N17
C6N1 0.069 4 0 C8,C9,C10,C12,C13,C14,N16
C6N1 0.069 4 2 C8,C9,C10,C11,C12,C14,N17
C6N1 0.069 4 2 C8,C9,C10,C11,C13,C14,N17
C6N1 0.069 4 0 C8,C9,C10,C11,C12,C14,N16
C6N1 0.069 4 1 C8,C10,C11,C12,C13,C14,N16
C6N1 0.069 4 1 C9,C10,C11,C12,C13,C14,N16


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