CID 57416472
2-oxo-2,3-dihydro-1h-pyrrolo[2,3-b]pyridin-5-ylboronic acid
Structural Information
- Molecular Formula
- C7H7BN2O3
- SMILES
- B(C1=CC2=C(NC(=O)C2)N=C1)(O)O
- InChI
- InChI=1S/C7H7BN2O3/c11-6-2-4-1-5(8(12)13)3-9-7(4)10-6/h1,3,12-13H,2H2,(H,9,10,11)
- InChIKey
- AUXRTOOHRROMLP-UHFFFAOYSA-N
- Compound name
- (2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-5-yl)boronic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 179.06226 | 134.1 |
[M+Na]+ | 201.04420 | 142.7 |
[M-H]- | 177.04770 | 132.4 |
[M+NH4]+ | 196.08880 | 152.4 |
[M+K]+ | 217.01814 | 139.4 |
[M+H-H2O]+ | 161.05224 | 128.2 |
[M+HCOO]- | 223.05318 | 151.0 |
[M+CH3COO]- | 237.06883 | 171.8 |
[M+Na-2H]- | 199.02965 | 138.7 |
[M]+ | 178.05443 | 131.0 |
[M]- | 178.05553 | 131.0 |
Literature stripe
No literature data available for this compound.