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Atom-Mass pairs
Submission id: KO002548

Outputs for Creatinine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO002548
Synonyms: Creatinine, 1-Methylglycocyamidine
Total mass: 113.1176
Formula: H7 C4 O1 N3

Experimental information


MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 44.0, 61.0, 66.5, 97.0,
Processing time: 0:00:01.507988

Results for the quried mass "40.8"

FormulaMass differencesNum. used protonsNum. required extra protonsAtom names
C2N1 0.252 3 1 C2,C4,N7
C2N1 0.252 3 1 C2,C3,N6
C2N1 0.252 3 1 C2,C3,N7
C1O1N1 0.209 1 0 C3,N6,O8
C1N2 0.232 1 0 C4,N5,N6
C1N2 0.232 1 0 C4,N5,N7
C1N2 0.232 1 1 C4,N6,N7
C2O1 0.229 1 0 C2,C3,O8


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