CID 179504
1,1,1-trifluoro-n,n-dimethylmethanesulfonamide
Structural Information
- Molecular Formula
- C3H6F3NO2S
- SMILES
- CN(C)S(=O)(=O)C(F)(F)F
- InChI
- InChI=1S/C3H6F3NO2S/c1-7(2)10(8,9)3(4,5)6/h1-2H3
- InChIKey
- GSIWUFBWQIELGP-UHFFFAOYSA-N
- Compound name
- 1,1,1-trifluoro-N,N-dimethylmethanesulfonamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 178.01442 | 126.6 |
[M+Na]+ | 199.99636 | 135.5 |
[M-H]- | 175.99986 | 125.2 |
[M+NH4]+ | 195.04096 | 147.5 |
[M+K]+ | 215.97030 | 135.4 |
[M+H-H2O]+ | 160.00440 | 119.7 |
[M+HCOO]- | 222.00534 | 141.9 |
[M+CH3COO]- | 236.02099 | 180.8 |
[M+Na-2H]- | 197.98181 | 131.2 |
[M]+ | 177.00659 | 125.9 |
[M]- | 177.00769 | 125.9 |