Processed databases
Atom-Mass pairs
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: 2.0158Out 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 "117.0723"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C7O2 | 0.009 | 1 | 0 | C1,C4,C5,C6,C8,C9,C12,O14,O15 |
| C7O2 | 0.009 | 1 | 0 | C1,C4,C5,C7,C8,C9,C12,O14,O15 |
| C7O2 | 0.009 | 1 | 0 | C2,C3,C6,C7,C9,C10,C11,O13,O16 |