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Submission id: KO003211
Outputs for 3-Indolebutyric acid; LC-ESI-QQ; MS2; CE:50 V; [M+H]+
Database: Institute for Advanced Biosciences, Keio Univ.
Entry ID: KO003211
Synonyms: 3-Indolebutyrate, Indolebutyric acid, 3-Indolebutyric acid
Total mass: 203.2366
Formula: H13 C12 O2 N1
Experimental information
MS type: MS2
Instrument: API3000, Applied Biosystems
Instrument type: LC-ESI-QQ
Ionization mode: POSITIVE
CAMP general report:
Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks:
Processing time: 0:00:02.252253
Results for the quried mass "106.1"
| Formula | Mass differences | Num. used protons | Num. required extra protons | Atom names |
| C6O2 |
0.021 |
2 |
0 |
C3,C4,C7,C8,C9,C12,O14,O15 |
| C6O2 |
0.021 |
2 |
0 |
C3,C4,C7,C9,C10,C12,O14,O15 |
| C6O1N1 |
0.002 |
4 |
0 |
C3,C4,C7,C8,C9,C12,N13,O14 |
| C6O1N1 |
0.002 |
4 |
0 |
C3,C4,C7,C8,C9,C12,N13,O15 |
| C7N1 |
0.045 |
8 |
2 |
C1,C2,C5,C6,C8,C10,C11,N13 |
| C7O1 |
0.022 |
6 |
0 |
C3,C4,C5,C7,C9,C10,C12,O14 |
| C7O1 |
0.022 |
6 |
0 |
C3,C4,C5,C7,C9,C10,C12,O15 |
| C7O1 |
0.022 |
6 |
0 |
C3,C4,C7,C9,C10,C11,C12,O14 |
| C7O1 |
0.022 |
6 |
0 |
C3,C4,C7,C9,C10,C11,C12,O15 |
| C7O1 |
0.022 |
6 |
0 |
C3,C4,C7,C8,C9,C10,C12,O14 |
| C7O1 |
0.022 |
6 |
0 |
C3,C4,C7,C8,C9,C10,C12,O15 |
| C9 |
0.019 |
2 |
0 |
C1,C2,C3,C4,C6,C7,C9,C10,C11 |
| C9 |
0.019 |
2 |
0 |
C1,C2,C3,C4,C5,C7,C9,C10,C12 |
| C9 |
0.019 |
2 |
0 |
C1,C2,C3,C4,C5,C6,C9,C10,C11 |
| C9 |
0.019 |
2 |
0 |
C1,C2,C3,C4,C6,C8,C9,C10,C11 |
| C9 |
0.019 |
2 |
0 |
C1,C2,C4,C5,C6,C8,C9,C10,C11 |
| C9 |
0.019 |
2 |
0 |
C1,C2,C3,C4,C5,C6,C7,C9,C10 |
| C9 |
0.019 |
2 |
0 |
C1,C3,C4,C5,C6,C7,C9,C10,C11 |
| C9 |
0.019 |
2 |
0 |
C1,C3,C4,C5,C7,C8,C9,C10,C12 |
| C9 |
0.019 |
2 |
0 |
C1,C3,C4,C5,C7,C9,C10,C11,C12 |
| C9 |
0.019 |
2 |
0 |
C2,C3,C4,C6,C7,C9,C10,C11,C12 |
| C9 |
0.019 |
2 |
0 |
C1,C2,C3,C4,C5,C7,C8,C9,C10 |
| C9 |
0.019 |
2 |
0 |
C1,C2,C3,C4,C5,C7,C9,C10,C11 |
| C9 |
0.019 |
2 |
0 |
C2,C3,C4,C5,C6,C7,C9,C10,C11 |
| C9 |
0.019 |
2 |
0 |
C2,C3,C4,C6,C7,C8,C9,C10,C11 |
| C9 |
0.019 |
2 |
0 |
C1,C2,C3,C4,C5,C6,C8,C9,C10 |
| C9 |
0.019 |
2 |
0 |
C3,C4,C5,C6,C7,C9,C10,C11,C12 |
| C9 |
0.019 |
2 |
0 |
C3,C4,C6,C7,C8,C9,C10,C11,C12 |
| C8 |
0.065 |
10 |
2 |
C1,C3,C4,C5,C7,C9,C10,C12 |
| C8 |
0.065 |
10 |
1 |
C1,C2,C3,C4,C5,C7,C9,C10 |
| C8 |
0.065 |
10 |
2 |
C1,C2,C3,C4,C5,C6,C9,C10 |
| C8 |
0.065 |
10 |
1 |
C1,C3,C4,C5,C7,C8,C9,C10 |
| C8 |
0.065 |
10 |
2 |
C1,C3,C4,C5,C7,C9,C10,C11 |
| C8 |
0.065 |
10 |
2 |
C2,C3,C4,C6,C7,C9,C10,C11 |
| C8 |
0.065 |
10 |
2 |
C1,C2,C3,C4,C5,C8,C9,C10 |
| C8 |
0.065 |
10 |
2 |
C3,C4,C5,C6,C7,C9,C10,C11 |
| C8 |
0.065 |
10 |
2 |
C3,C4,C5,C7,C8,C9,C10,C12 |
| C8 |
0.065 |
10 |
2 |
C3,C4,C6,C7,C8,C9,C10,C11 |
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