CID 2737168
Ethyl 2,2-dibromo-2-fluoroacetate
Structural Information
- Molecular Formula
- C4H5Br2FO2
- SMILES
- CCOC(=O)C(F)(Br)Br
- InChI
- InChI=1S/C4H5Br2FO2/c1-2-9-3(8)4(5,6)7/h2H2,1H3
- InChIKey
- COYRDMUQLSIAEX-UHFFFAOYSA-N
- Compound name
- ethyl 2,2-dibromo-2-fluoroacetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 262.87132 | 136.1 |
[M+Na]+ | 284.85326 | 147.3 |
[M-H]- | 260.85676 | 139.5 |
[M+NH4]+ | 279.89786 | 156.3 |
[M+K]+ | 300.82720 | 132.5 |
[M+H-H2O]+ | 244.86130 | 143.9 |
[M+HCOO]- | 306.86224 | 150.3 |
[M+CH3COO]- | 320.87789 | 197.0 |
[M+Na-2H]- | 282.83871 | 143.3 |
[M]+ | 261.86349 | 169.7 |
[M]- | 261.86459 | 169.7 |