Processed databases
Atom-Mass pairs
Outputs for Indoleacetic acid; GC-EI-TOF; MS; 2 TMS; BP:73
Database: Plant Science Center, RIKEN
Entry ID: PR010198
Synonyms: Indole-3-acetic acid, Indole-3-acetate, Indoleacetate, Indoleacetic acid
Total mass: 175.1836
Formula: H9 C10 O2 N1
Experimental information
MS type: MS
Instrument: Pegasus III TOF-MS system, Leco; GC 6890, Agilent Technologies
Instrument type: GC-EI-TOF
Ionization mode: POSITIVE
CAMP general report:
Acceptable mass threshold: 2.0158Out of range queried mass peaks: 182.0,185.0,188.0,198.0,201.0,204.0,214.0,229.0,232.0,248.0,260.0,275.0,278.0,304.0,318.0,321.0,
Replicated queried mass peaks: 61.0, 62.0, 64.0, 65.0, 67.0, 70.0, 71.0, 73.0, 74.0, 76.0, 77.0, 79.0, 80.0, 84.0, 85.0, 87.0, 88.0, 90.0, 91.0, 93.0, 94.0, 100.0, 101.0, 103.0, 104.0, 106.0, 107.0, 114.0, 115.0, 117.0, 118.0, 120.0, 128.0, 129.0, 131.0, 132.0, 134.0, 135.0, 141.0, 142.0, 144.0, 145.0, 147.0, 148.0, 154.0, 156.0, 157.0, 159.0, 160.0, 162.0, 169.0, 170.0, 172.0, 173.0, 184.0, 186.0, 187.0, 189.0, 199.0, 200.0, 202.0, 203.0, 205.0, 216.0, 230.0, 231.0, 276.0, 277.0, 305.0, 306.0, 319.0, 320.0, 322.0,
Processing time: 0:00:02.687259
Results for the quried mass "89.0"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C6N1 | 0.095 | 3 | 0 | C1,C2,C3,C4,C8,C9,N11 |
| C6N1 | 0.095 | 3 | 0 | C1,C2,C3,C4,C6,C9,N11 |
| C6O1 | 0.071 | 1 | 0 | C1,C3,C5,C7,C8,C10,O12 |
| C6O1 | 0.071 | 1 | 0 | C1,C3,C5,C7,C8,C10,O13 |
| C6O1 | 0.071 | 1 | 0 | C3,C5,C6,C7,C8,C10,O12 |
| C6O1 | 0.071 | 1 | 0 | C3,C5,C7,C8,C9,C10,O12 |
| C6O1 | 0.071 | 1 | 0 | C3,C5,C6,C7,C8,C10,O13 |
| C6O1 | 0.071 | 1 | 0 | C3,C5,C7,C8,C9,C10,O13 |
| C6O1 | 0.071 | 1 | 0 | C4,C5,C7,C8,C9,C10,O12 |
| C6O1 | 0.071 | 1 | 0 | C4,C5,C7,C8,C9,C10,O13 |
| C6O1 | 0.071 | 1 | 0 | C5,C6,C7,C8,C9,C10,O12 |
| C6O1 | 0.071 | 1 | 0 | C5,C6,C7,C8,C9,C10,O13 |
| C7 | 0.114 | 5 | 0 | C1,C2,C4,C5,C7,C8,C9 |
| C7 | 0.114 | 5 | 1 | C1,C2,C4,C6,C7,C8,C9 |
| C7 | 0.114 | 5 | 0 | C1,C2,C3,C5,C7,C8,C10 |
| C7 | 0.114 | 5 | 1 | C1,C2,C3,C4,C7,C8,C9 |
| C7 | 0.114 | 5 | 0 | C1,C2,C3,C4,C5,C7,C8 |
| C7 | 0.114 | 5 | 0 | C1,C2,C3,C4,C6,C7,C8 |
| C7 | 0.114 | 5 | 0 | C1,C3,C4,C5,C7,C8,C9 |
| C7 | 0.114 | 5 | 1 | C1,C3,C4,C6,C7,C8,C9 |
| C7 | 0.114 | 5 | 0 | C1,C3,C5,C6,C7,C8,C10 |
| C7 | 0.114 | 5 | 1 | C1,C3,C5,C7,C8,C9,C10 |
| C7 | 0.114 | 5 | 0 | C1,C2,C3,C5,C7,C8,C9 |
| C7 | 0.114 | 5 | 1 | C1,C2,C3,C6,C7,C8,C9 |
| C7 | 0.114 | 5 | 1 | C2,C4,C5,C7,C8,C9,C10 |
| C7 | 0.114 | 5 | 0 | C1,C2,C3,C5,C6,C7,C8 |
| C7 | 0.114 | 5 | 0 | C2,C3,C4,C5,C7,C8,C9 |
| C7 | 0.114 | 5 | 1 | C2,C3,C4,C6,C7,C8,C9 |
| C7 | 0.114 | 5 | 0 | C2,C4,C5,C6,C7,C8,C9 |
| C7 | 0.114 | 5 | 1 | C3,C4,C5,C7,C8,C9,C10 |
| C7 | 0.114 | 5 | 0 | C3,C4,C5,C6,C7,C8,C9 |
| C7 | 0.114 | 5 | 1 | C3,C5,C6,C7,C8,C9,C10 |
| C7 | 0.114 | 5 | 1 | C4,C5,C6,C7,C8,C9,C10 |
| C5O1N1 | 0.052 | 1 | 0 | C5,C6,C7,C9,C10,N11,O12 |
| C5O1N1 | 0.052 | 1 | 0 | C5,C6,C7,C9,C10,N11,O13 |
| C5O1N1 | 0.052 | 1 | 0 | C5,C7,C8,C9,C10,N11,O12 |
| C5O1N1 | 0.052 | 1 | 0 | C5,C7,C8,C9,C10,N11,O13 |
| C5O1N1 | 0.052 | 1 | 0 | C5,C6,C7,C8,C10,N11,O12 |
| C5O1N1 | 0.052 | 1 | 0 | C5,C6,C7,C8,C10,N11,O13 |