CID 54148084
4,4-difluoropentan-1-ol
Structural Information
- Molecular Formula
- C5H10F2O
- SMILES
- CC(CCCO)(F)F
- InChI
- InChI=1S/C5H10F2O/c1-5(6,7)3-2-4-8/h8H,2-4H2,1H3
- InChIKey
- AVKWYAWXQNRRLC-UHFFFAOYSA-N
- Compound name
- 4,4-difluoropentan-1-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 125.07725 | 122.7 |
[M+Na]+ | 147.05919 | 130.4 |
[M-H]- | 123.06269 | 119.2 |
[M+NH4]+ | 142.10379 | 144.5 |
[M+K]+ | 163.03313 | 129.6 |
[M+H-H2O]+ | 107.06723 | 117.5 |
[M+HCOO]- | 169.06817 | 141.9 |
[M+CH3COO]- | 183.08382 | 169.3 |
[M+Na-2H]- | 145.04464 | 129.3 |
[M]+ | 124.06942 | 120.2 |
[M]- | 124.07052 | 120.2 |