CID 9828
4'-fluoroacetophenone
Structural Information
- Molecular Formula
- C8H7FO
- SMILES
- CC(=O)C1=CC=C(C=C1)F
- InChI
- InChI=1S/C8H7FO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3
- InChIKey
- ZDPAWHACYDRYIW-UHFFFAOYSA-N
- Compound name
- 1-(4-fluorophenyl)ethanone
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 139.05538 | 122.9 |
[M+Na]+ | 161.03732 | 131.9 |
[M-H]- | 137.04082 | 125.8 |
[M+NH4]+ | 156.08192 | 144.9 |
[M+K]+ | 177.01126 | 130.3 |
[M+H-H2O]+ | 121.04536 | 117.1 |
[M+HCOO]- | 183.04630 | 146.3 |
[M+CH3COO]- | 197.06195 | 174.1 |
[M+Na-2H]- | 159.02277 | 129.4 |
[M]+ | 138.04755 | 121.9 |
[M]- | 138.04865 | 121.9 |