Metoclopramide; LC-ESI-ITFT; MS2; CE: 90%; R=30000; [M+H]+

Computational Annotation of MS Peaks (CAMP)

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Submission id: EA278113

Outputs for Metoclopramide; LC-ESI-ITFT; MS2; CE: 90%; R=30000; [M+H]+

Database: Department of Environmental Chemistry, Eawag
Entry ID: EA278113
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, 92.0494, 100.112, 128.0261, 148.063, 156.021, 168.9924, 170.0002, 182.024, 183.0319, 212.0346,
Processing time: 0:00:03.720680

Results for the quried mass "187.003"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C8N1O2Cl1	0.388	9	1	C3,C8,C9,C10,C11,C12,C13,C14,Cl15,N16,O19,O20