CID 86233917
Schembl5488884
Structural Information
- Molecular Formula
- C5H7F5O4S
- SMILES
- C(CC(C(F)(F)F)(F)F)COS(=O)(=O)O
- InChI
- InChI=1S/C5H7F5O4S/c6-4(7,5(8,9)10)2-1-3-14-15(11,12)13/h1-3H2,(H,11,12,13)
- InChIKey
- SZNKTIUSIMCHRA-UHFFFAOYSA-N
- Compound name
- 4,4,5,5,5-pentafluoropentyl hydrogen sulfate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 259.00582 | 143.7 |
[M+Na]+ | 280.98776 | 152.0 |
[M-H]- | 256.99126 | 136.4 |
[M+NH4]+ | 276.03236 | 159.9 |
[M+K]+ | 296.96170 | 149.8 |
[M+H-H2O]+ | 240.99580 | 135.4 |
[M+HCOO]- | 302.99674 | 152.3 |
[M+CH3COO]- | 317.01239 | 186.3 |
[M+Na-2H]- | 278.97321 | 147.5 |
[M]+ | 257.99799 | 141.0 |
[M]- | 257.99909 | 141.0 |
Literature stripe
No literature data available for this compound.