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Submission id: BML00710

Outputs for Bergapten; LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+


Database: Institute of Biological Chemistry, Washington State University
Entry ID: BML00710
Synonyms: Bergapten
Total mass: 216.1892
Formula: H8 C12 O4

Experimental information


MS type: MS2
Instrument: Agilent 1200 RRLC; Agilent 6520 QTOF
Instrument type: LC-ESI-QTOF
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 118.0425, 131.0498, 145.0235, 145.0627, 161.065, 173.0574, 174.0295, 174.076, 202.0644, 202.0851, 202.1249, 202.1568, 202.202, 202.3609,
Processing time: 0:00:02.267602

Results for the quried mass "105.0719"

FormulaMass differencesNum. used protonsNum. required extra protonsAtom names
C6O2 0.001 1 0 C1,C4,C5,C8,C9,C12,O14,O15
C6O2 0.001 1 0 C1,C4,C5,C7,C8,C12,O14,O15
C6O2 0.001 1 0 C4,C5,C6,C8,C9,C10,O15,O16
C6O2 0.001 1 0 C2,C3,C6,C7,C10,C11,O13,O16
C7O1 0.042 5 2 C2,C3,C6,C7,C9,C10,C11,O15
C7O1 0.042 5 2 C2,C4,C5,C7,C8,C9,C12,O15
C7O1 0.042 5 1 C2,C4,C5,C6,C7,C9,C10,O15
C7O1 0.042 5 2 C2,C3,C6,C8,C9,C10,C11,O16
C7O1 0.042 5 1 C2,C3,C4,C5,C7,C8,C12,O15
C7O1 0.042 5 1 C2,C3,C5,C6,C7,C9,C10,O15
C7O1 0.042 5 2 C2,C3,C5,C7,C8,C9,C12,O15
C7O1 0.042 5 2 C2,C3,C6,C7,C9,C10,C11,O16
C7O1 0.042 5 2 C2,C3,C6,C7,C10,C11,C12,O16
C7O1 0.042 5 2 C2,C3,C4,C7,C8,C11,C12,O13
C7O1 0.042 5 2 C2,C3,C6,C7,C9,C10,C11,O13
C7O1 0.042 5 2 C2,C3,C4,C7,C8,C11,C12,O16
C7O1 0.042 5 2 C2,C4,C5,C7,C8,C10,C12,O16
C7O1 0.042 5 2 C2,C4,C5,C7,C8,C10,C12,O15
C7O1 0.042 5 2 C2,C4,C6,C7,C8,C9,C10,O15
C7O1 0.042 5 2 C2,C4,C6,C7,C8,C9,C10,O16
C7O1 0.042 5 2 C2,C5,C6,C7,C8,C9,C10,O15
C7O1 0.042 5 2 C2,C5,C6,C7,C9,C10,C12,O15
C7O1 0.042 5 2 C2,C5,C6,C7,C8,C9,C12,O15
C7O1 0.042 5 2 C2,C3,C4,C7,C8,C10,C12,O16
C7O1 0.042 5 2 C2,C3,C6,C7,C8,C9,C10,O16
C7O1 0.042 5 2 C2,C3,C6,C7,C10,C11,C12,O13
C7O1 0.042 5 2 C2,C3,C4,C7,C8,C11,C12,O14
C7O1 0.042 5 2 C2,C3,C6,C7,C10,C11,C12,O14
C7O1 0.042 5 2 C2,C3,C6,C7,C9,C10,C12,O15
C7O1 0.042 5 1 C2,C3,C4,C5,C7,C8,C12,O14
C7O1 0.042 5 2 C2,C3,C6,C7,C8,C9,C12,O14
C7O1 0.042 5 2 C2,C3,C6,C7,C9,C10,C12,O14
C7O1 0.042 5 2 C2,C4,C6,C7,C8,C9,C12,O14
C7O1 0.042 5 2 C2,C4,C6,C7,C8,C10,C12,O14
C7O1 0.042 5 2 C2,C4,C6,C7,C8,C10,C12,O16
C7O1 0.042 5 2 C2,C4,C5,C7,C8,C9,C12,O14
C7O1 0.042 5 2 C2,C4,C5,C7,C8,C10,C12,O14
C7O1 0.042 5 2 C2,C3,C6,C7,C8,C10,C12,O16
C7O1 0.042 5 2 C2,C3,C6,C7,C8,C10,C12,O14
C7O1 0.042 5 2 C2,C3,C4,C7,C8,C10,C12,O14
C7O1 0.042 5 2 C2,C3,C6,C7,C9,C10,C12,O16
C7O1 0.042 5 2 C3,C4,C6,C8,C9,C10,C11,O16
C7O1 0.042 5 2 C2,C3,C4,C7,C8,C9,C12,O15
C7O1 0.042 5 2 C2,C3,C6,C7,C8,C9,C10,O15
C7O1 0.042 5 2 C2,C3,C6,C7,C8,C9,C12,O15
C7O1 0.042 5 2 C4,C5,C6,C7,C9,C10,C12,O15
C7O1 0.042 5 2 C4,C5,C6,C8,C9,C10,C11,O16
C7O1 0.042 5 2 C4,C5,C6,C7,C8,C9,C10,O15
C7O1 0.042 5 2 C4,C5,C6,C8,C9,C10,C12,O15
C7O1 0.042 5 2 C4,C5,C6,C7,C8,C9,C12,O15
C7O1 0.042 5 2 C4,C5,C6,C7,C8,C10,C12,O15
C7O1 0.042 5 2 C4,C5,C6,C8,C9,C10,C12,O16
C7O1 0.042 5 2 C4,C5,C6,C7,C8,C10,C12,O14
C7O1 0.042 5 2 C4,C5,C6,C8,C9,C10,C12,O14
C7O1 0.042 5 2 C4,C5,C6,C7,C8,C9,C12,O14
C7O1 0.042 5 2 C4,C5,C6,C7,C8,C9,C10,O16
C7O1 0.042 5 2 C4,C5,C6,C7,C8,C10,C12,O16
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