CID 73994686
1,1,1-trifluoropropane-2-sulfonyl chloride
Structural Information
- Molecular Formula
- C3H4ClF3O2S
- SMILES
- CC(C(F)(F)F)S(=O)(=O)Cl
- InChI
- InChI=1S/C3H4ClF3O2S/c1-2(3(5,6)7)10(4,8)9/h2H,1H3
- InChIKey
- NUUBIXUITNNERY-UHFFFAOYSA-N
- Compound name
- 1,1,1-trifluoropropane-2-sulfonyl chloride
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 196.96454 | 126.3 |
[M+Na]+ | 218.94648 | 136.4 |
[M-H]- | 194.94998 | 123.8 |
[M+NH4]+ | 213.99108 | 147.0 |
[M+K]+ | 234.92042 | 133.6 |
[M+H-H2O]+ | 178.95452 | 121.2 |
[M+HCOO]- | 240.95546 | 134.9 |
[M+CH3COO]- | 254.97111 | 177.3 |
[M+Na-2H]- | 216.93193 | 130.0 |
[M]+ | 195.95671 | 126.4 |
[M]- | 195.95781 | 126.4 |
Literature stripe
No literature data available for this compound.