CID 735926
2-amino-6-bromo-3-formylchromone
Structural Information
- Molecular Formula
- C10H6BrNO3
- SMILES
- C1=CC2=C(C=C1Br)C(=O)C(=C(O2)N)C=O
- InChI
- InChI=1S/C10H6BrNO3/c11-5-1-2-8-6(3-5)9(14)7(4-13)10(12)15-8/h1-4H,12H2
- InChIKey
- AUIUQJYBTPKQGS-UHFFFAOYSA-N
- Compound name
- 2-amino-6-bromo-4-oxochromene-3-carbaldehyde
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 267.96040 | 145.6 |
[M+Na]+ | 289.94234 | 159.6 |
[M-H]- | 265.94584 | 153.9 |
[M+NH4]+ | 284.98694 | 165.5 |
[M+K]+ | 305.91628 | 149.0 |
[M+H-H2O]+ | 249.95038 | 145.0 |
[M+HCOO]- | 311.95132 | 167.3 |
[M+CH3COO]- | 325.96697 | 195.1 |
[M+Na-2H]- | 287.92779 | 154.4 |
[M]+ | 266.95257 | 166.3 |
[M]- | 266.95367 | 166.3 |