Processed databases
Atom-Mass pairs
Outputs for Bergapten; LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
Database: Institute of Biological Chemistry, Washington State University
Entry ID: BML00719
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: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 102.0445, 105.0347, 117.0331, 118.0748, 118.0938, 118.1426, 119.0145, 120.0173, 128.025, 129.0314, 146.034, 146.0681, 174.0294,
Processing time: 0:00:02.243980
Results for the quried mass "115.0539"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C7O2 | 0.012 | 1 | 0 | C1,C4,C5,C6,C8,C9,C12,O14,O15 |
| C7O2 | 0.012 | 1 | 0 | C1,C4,C5,C7,C8,C9,C12,O14,O15 |