N-methylnicotinate; LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M+H]+

Computational Annotation of MS Peaks (CAMP)

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Atom-Mass pairs

Submission id: ML005201

Outputs for N-methylnicotinate; LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M+H]+

Database: European Molecular Biology Laboratory - European Bioinformatics Institute (EMBL-EBI), Hinxton, UK.
Entry ID: ML005201
Synonyms: N-methylnicotinate, 1-methylpyridin-1-ium-3-carboxylate
Total mass: 137.1357
Formula: H7 C7 O2 N1

Experimental information

MS type: MS2
Instrument: LTQ Orbitrap Velos 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: 93.0572, 94.0654,
Processing time: 0:00:01.231187

Results for the quried mass "92.0497"

Formula	Mass differences	Num. used protons	Num. required extra protons	Atom names
C5O2	0.003	0	0	C2,C3,C5,C6,C7,O9,O10
C5O2	0.003	0	0	C2,C3,C4,C6,C7,O9,O10
C6N1	0.069	6	0	C1,C2,C3,C4,C5,C6,N8
C4O2N1	0.017	2	0	C1,C5,C6,C7,N8,O9,O10