CID 105459763
3,3-difluoropentane-1-sulfonyl chloride
Structural Information
- Molecular Formula
- C5H9ClF2O2S
- SMILES
- CCC(CCS(=O)(=O)Cl)(F)F
- InChI
- InChI=1S/C5H9ClF2O2S/c1-2-5(7,8)3-4-11(6,9)10/h2-4H2,1H3
- InChIKey
- OPKAXIDAKLUDDG-UHFFFAOYSA-N
- Compound name
- 3,3-difluoropentane-1-sulfonyl chloride
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 207.00527 | 134.7 |
[M+Na]+ | 228.98721 | 144.1 |
[M-H]- | 204.99071 | 133.1 |
[M+NH4]+ | 224.03181 | 155.2 |
[M+K]+ | 244.96115 | 140.7 |
[M+H-H2O]+ | 188.99525 | 130.0 |
[M+HCOO]- | 250.99619 | 144.7 |
[M+CH3COO]- | 265.01184 | 180.3 |
[M+Na-2H]- | 226.97266 | 138.8 |
[M]+ | 205.99744 | 137.4 |
[M]- | 205.99854 | 137.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.