CID 58950950
2,2-difluorocyclopentan-1-one
Structural Information
- Molecular Formula
- C5H6F2O
- SMILES
- C1CC(=O)C(C1)(F)F
- InChI
- InChI=1S/C5H6F2O/c6-5(7)3-1-2-4(5)8/h1-3H2
- InChIKey
- CQIJELIGXJMXCE-UHFFFAOYSA-N
- Compound name
- 2,2-difluorocyclopentan-1-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 121.04595 | 117.1 |
[M+Na]+ | 143.02789 | 126.2 |
[M-H]- | 119.03139 | 118.5 |
[M+NH4]+ | 138.07249 | 143.3 |
[M+K]+ | 159.00183 | 125.3 |
[M+H-H2O]+ | 103.03593 | 111.9 |
[M+HCOO]- | 165.03687 | 139.1 |
[M+CH3COO]- | 179.05252 | 167.4 |
[M+Na-2H]- | 141.01334 | 122.6 |
[M]+ | 120.03812 | 112.4 |
[M]- | 120.03922 | 112.4 |