Processed databases
Atom-Mass pairs
Outputs for 5-Methoxy-3-indoleacetic acid; LC-ESI-QQ; MS2; CE:30 V; [M+H]+
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003479
Synonyms: 5-Methoxy-3-indoleaceate, 5-Methoxyindoleacetate, 5-Methoxy-3-indoleacetic acid
Total mass: 205.2095
Formula: H11 C11 O3 N1
Experimental information
MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 72.1, 73.3, 82.0, 83.1, 86.2, 86.8, 88.9, 101.2, 105.1, 106.1, 128.8, 129.2, 133.0, 146.1, 161.3,
Processing time: 0:00:02.878979
Results for the quried mass "78.8"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C4O1N1 | 0.257 | 1 | 0 | C2,C3,C8,C10,N12,O15 |
| C4O1N1 | 0.257 | 1 | 0 | C4,C6,C7,C11,N12,O13 |
| C4O1N1 | 0.257 | 1 | 0 | C4,C6,C7,C11,N12,O14 |
| C4O1N1 | 0.257 | 1 | 0 | C5,C8,C9,C10,N12,O15 |
| C5N1 | 0.300 | 5 | 1 | C2,C3,C6,C7,C10,N12 |
| C5N1 | 0.300 | 5 | 2 | C2,C5,C8,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 1 | C2,C3,C5,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 1 | C2,C3,C6,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 1 | C2,C3,C6,C8,C10,N12 |
| C5N1 | 0.300 | 5 | 2 | C2,C3,C7,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 1 | C2,C3,C5,C8,C10,N12 |
| C5N1 | 0.300 | 5 | 2 | C2,C3,C8,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 0 | C3,C4,C6,C7,C10,N12 |
| C5N1 | 0.300 | 5 | 2 | C3,C6,C7,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 1 | C3,C4,C7,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 2 | C3,C5,C8,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 1 | C3,C5,C6,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 2 | C3,C5,C7,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 1 | C4,C6,C7,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 0 | C4,C5,C6,C7,C9,N12 |
| C5N1 | 0.300 | 5 | 1 | C4,C5,C7,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 1 | C4,C6,C7,C10,C11,N12 |
| C5N1 | 0.300 | 5 | 2 | C4,C7,C9,C10,C11,N12 |
| C5N1 | 0.300 | 5 | 1 | C4,C6,C7,C9,C11,N12 |
| C5N1 | 0.300 | 5 | 2 | C5,C6,C7,C9,C10,N12 |
| C5N1 | 0.300 | 5 | 2 | C5,C6,C7,C8,C9,N12 |
| C5N1 | 0.300 | 5 | 2 | C5,C6,C8,C9,C10,N12 |
| C5O1 | 0.277 | 3 | 1 | C2,C3,C8,C9,C10,O15 |
| C5O1 | 0.277 | 3 | 1 | C2,C5,C7,C8,C9,O15 |
| C5O1 | 0.277 | 3 | 1 | C2,C5,C8,C9,C10,O15 |
| C5O1 | 0.277 | 3 | 0 | C2,C3,C5,C8,C9,O15 |
| C5O1 | 0.277 | 3 | 0 | C2,C3,C5,C8,C10,O15 |
| C5O1 | 0.277 | 3 | 1 | C3,C5,C8,C9,C10,O15 |
| C5O1 | 0.277 | 3 | 0 | C4,C5,C7,C8,C9,O15 |
| C5O1 | 0.277 | 3 | 0 | C4,C5,C7,C9,C11,O13 |
| C5O1 | 0.277 | 3 | 0 | C4,C5,C7,C9,C11,O14 |
| C5O1 | 0.277 | 3 | 1 | C4,C7,C9,C10,C11,O13 |
| C5O1 | 0.277 | 3 | 0 | C4,C7,C9,C10,C11,O14 |
| C5O1 | 0.277 | 3 | 0 | C4,C6,C7,C9,C11,O13 |
| C5O1 | 0.277 | 3 | 0 | C4,C6,C7,C9,C11,O14 |
| C5O1 | 0.277 | 3 | 1 | C5,C6,C7,C8,C9,O15 |
| C5O1 | 0.277 | 3 | 2 | C5,C7,C8,C9,C10,O15 |
| C4O2 | 0.234 | 1 | 0 | C4,C6,C7,C11,O13,O14 |
| C4O2 | 0.234 | 1 | 0 | C4,C7,C9,C11,O13,O14 |