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Atom-Mass pairs
Submission id: KO001075

Outputs for Homovanillic acid; LC-ESI-QQ; MS2; CE:50 V; [M-H]-


Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO001075
Synonyms: Homovanillate, Homovanillic acid
Total mass: 182.1729
Formula: H10 C9 O4

Experimental information


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

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks:
Processing time: 0:00:01.988809

Results for the quried mass "67.1"

FormulaMass differencesNum. used protonsNum. required extra protonsAtom names
C4O1 0.034 3 0 C2,C5,C6,C9,O11
C4O1 0.034 3 0 C2,C5,C6,C9,O12
C4O1 0.034 3 1 C2,C3,C7,C8,O13
C4O1 0.034 3 1 C2,C4,C6,C8,O13
C4O1 0.034 3 0 C2,C3,C7,C8,O10
C4O1 0.034 3 0 C2,C3,C6,C7,O10
C4O1 0.034 3 1 C3,C4,C7,C8,O13
C4O1 0.034 3 0 C3,C4,C7,C8,O10
C4O1 0.034 3 0 C4,C5,C6,C9,O11
C4O1 0.034 3 0 C4,C5,C6,C9,O12
C4O1 0.034 3 0 C4,C5,C6,C8,O13
C4O1 0.034 3 1 C4,C6,C7,C8,O10
C5 0.009 7 2 C2,C3,C4,C5,C6
C3O2 0.077 1 0 C3,C7,C8,O10,O13
C3O2 0.077 1 0 C4,C7,C8,O10,O13
C3O2 0.077 1 0 C5,C6,C9,O11,O12


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