Processed databases
Atom-Mass pairs
Outputs for Esculetin; LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
Database: Institute of Biological Chemistry, Washington State University
Entry ID: BML01674
Synonyms: Esculetin
Total mass: 178.1413
Formula: H6 C9 O4
Experimental information
MS type: MS2
Instrument: Agilent 1200 RRLC; Agilent 6520 QTOF
Instrument type: LC-ESI-QTOF
Ionization mode: NEGATIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 133.059, 177.019,
Processing time: 0:00:01.175046
Results for the quried mass "105.0329"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C6O2 | 0.038 | 1 | 0 | C3,C4,C5,C6,C7,C8,O10,O11 |
| C6O2 | 0.038 | 1 | 0 | C1,C3,C4,C5,C6,C7,O10,O11 |
| C6O2 | 0.038 | 1 | 0 | C1,C2,C4,C5,C8,C9,O12,O13 |
| C6O2 | 0.038 | 1 | 0 | C1,C2,C3,C5,C8,C9,O12,O13 |
| C6O2 | 0.038 | 1 | 0 | C1,C2,C3,C5,C6,C7,O10,O11 |
| C6O2 | 0.038 | 1 | 0 | C1,C2,C3,C5,C6,C9,O10,O12 |