CID 107575352
1929360-80-4
Structural Information
- Molecular Formula
- C14H13BrClNO2
- SMILES
- CCOC(=O)C1=CN=C2C=C(C(=C(C2=C1Cl)C)Br)C
- InChI
- InChI=1S/C14H13BrClNO2/c1-4-19-14(18)9-6-17-10-5-7(2)12(15)8(3)11(10)13(9)16/h5-6H,4H2,1-3H3
- InChIKey
- FKUFTOCSTKEFOB-UHFFFAOYSA-N
- Compound name
- ethyl 6-bromo-4-chloro-5,7-dimethylquinoline-3-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 341.98908 | 164.1 |
[M+Na]+ | 363.97102 | 178.8 |
[M-H]- | 339.97452 | 170.7 |
[M+NH4]+ | 359.01562 | 183.1 |
[M+K]+ | 379.94496 | 165.8 |
[M+H-H2O]+ | 323.97906 | 164.2 |
[M+HCOO]- | 385.98000 | 178.4 |
[M+CH3COO]- | 399.99565 | 208.1 |
[M+Na-2H]- | 361.95647 | 168.9 |
[M]+ | 340.98125 | 188.7 |
[M]- | 340.98235 | 188.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.