CID 3549191
Propane-2-sulfonamide
Structural Information
- Molecular Formula
- C3H9NO2S
- SMILES
- CC(C)S(=O)(=O)N
- InChI
- InChI=1S/C3H9NO2S/c1-3(2)7(4,5)6/h3H,1-2H3,(H2,4,5,6)
- InChIKey
- SJMCLWCCNYAWRQ-UHFFFAOYSA-N
- Compound name
- propane-2-sulfonamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 124.04268 | 121.5 |
[M+Na]+ | 146.02462 | 129.6 |
[M-H]- | 122.02812 | 122.0 |
[M+NH4]+ | 141.06922 | 143.7 |
[M+K]+ | 161.99856 | 128.9 |
[M+H-H2O]+ | 106.03266 | 117.2 |
[M+HCOO]- | 168.03360 | 139.3 |
[M+CH3COO]- | 182.04925 | 169.4 |
[M+Na-2H]- | 144.01007 | 125.2 |
[M]+ | 123.03485 | 122.1 |
[M]- | 123.03595 | 122.1 |