CID 125493012
4-chlorophenyl (2,2,3,3,4,4,4-heptafluorobutanoyl)sulfamate
Structural Information
- Molecular Formula
- C10H5ClF7NO4S
- SMILES
- C1=CC(=CC=C1OS(=O)(=O)NC(=O)C(C(C(F)(F)F)(F)F)(F)F)Cl
- InChI
- InChI=1S/C10H5ClF7NO4S/c11-5-1-3-6(4-2-5)23-24(21,22)19-7(20)8(12,13)9(14,15)10(16,17)18/h1-4H,(H,19,20)
- InChIKey
- JFPOJRKSHNMRDK-UHFFFAOYSA-N
- Compound name
- (4-chlorophenyl) N-(2,2,3,3,4,4,4-heptafluorobutanoyl)sulfamate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 403.95888 | 169.3 |
[M+Na]+ | 425.94082 | 178.3 |
[M-H]- | 401.94432 | 164.5 |
[M+NH4]+ | 420.98542 | 180.7 |
[M+K]+ | 441.91476 | 173.4 |
[M+H-H2O]+ | 385.94886 | 158.8 |
[M+HCOO]- | 447.94980 | 171.8 |
[M+CH3COO]- | 461.96545 | 214.1 |
[M+Na-2H]- | 423.92627 | 173.3 |
[M]+ | 402.95105 | 165.3 |
[M]- | 402.95215 | 165.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.