Processed databases
Atom-Mass pairs
Related entries (identical compound):
PR010198
PR010197
KO003214
KZ000036
KO003216
KO003213
PB000514
PB000510
PB000511
PB000512
PB000513
PR020128
KO003215
KO001230
KO003212
MT000032
JP001408
PR100570
KO001229
KO001228
KO001227
KO001226
PR100148
PR100149
KZ000144
KZ000142
KZ000143
Outputs for Indoleacetic acid; LC-ESI-QTOF; MS2; CE:50 eV; [M+H]+
Database: Institute of Plant Biochemistry, Halle, Germany
Entry ID: PB000514
Synonyms: Indoleacetic acid , 2-(1H-indol-3-yl)acetic acid
Total mass: 175.1836
Formula: H9 C10 O2 N1
Structure file (with ALATIS unique atom labels)
Experimental information
MS type: MS2Instrument: API QSTAR Pulsar i
Instrument type: LC-ESI-QTOF
Ionization: ESI
Ionization mode: POSITIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks:
Replicated queried mass peaks: 43.014, 51.023, 52.029, 55.015, 55.055, 62.928, 63.022, 64.026, 65.038, 66.044, 76.028, 77.037, 79.041, 80.044, 89.038, 91.052, 92.06, 94.042, 96.046, 102.045, 103.055, 105.056, 106.06, 115.041, 116.048, 118.065, 119.04, 129.05, 131.068, 132.043, 134.055, 144.052,
Processing time: 0:00:02.352611
Queried mass list: ['39.021', '41.040', '45.029', '50.015', '53.046', '57.936', '62.017', '64.928', '67.055', '75.022', '78.045', '80.978', '88.026', '90.045', '93.032', '95.049', '98.985', '101.040', '104.049', '114.035', '117.058', '121.067', '128.046', '130.063', '133.050', '143.031', '146.060']
| Queried mass | Num. matched formulas | Num. matched fragments |
| 39.021 (link to fragments) | 3 | 17 |
| 41.04 (link to fragments) | 3 | 9 |
| 45.029 (link to fragments) | 2 | 2 |
| 50.015 (link to fragments) | 2 | 25 |
| 53.046 (link to fragments) | 3 | 17 |
| 57.936 (link to fragments) | 1 | 1 |
| 62.017 (link to fragments) | 2 | 37 |
| 64.928 (link to fragments) | 3 | 35 |
| 67.055 (link to fragments) | 3 | 18 |
| 75.022 (link to fragments) | 3 | 50 |
| 78.045 (link to fragments) | 5 | 44 |
| 80.978 (link to fragments) | 4 | 13 |
| 88.026 (link to fragments) | 3 | 31 |
| 90.045 (link to fragments) | 5 | 39 |
| 93.032 (link to fragments) | 5 | 21 |
| 95.049 (link to fragments) | 2 | 3 |
| 98.985 (link to fragments) | 2 | 2 |
| 101.04 (link to fragments) | 2 | 2 |
| 104.049 (link to fragments) | 3 | 5 |
| 114.035 (link to fragments) | 1 | 1 |
| 117.058 (link to fragments) | 3 | 6 |
| 121.067 (link to fragments) | 3 | 6 |
| 128.046 (link to fragments) | 2 | 3 |
| 130.063 (link to fragments) | 3 | 7 |
| 133.05 (link to fragments) | 2 | 6 |
| 143.031 (link to fragments) | 2 | 6 |
| 146.06 (link to fragments) | 2 | 6 |