CID 131264248
2,3,4-trifluoro-5-sulfamoylbenzoic acid
Structural Information
- Molecular Formula
- C7H4F3NO4S
- SMILES
- C1=C(C(=C(C(=C1S(=O)(=O)N)F)F)F)C(=O)O
- InChI
- InChI=1S/C7H4F3NO4S/c8-4-2(7(12)13)1-3(16(11,14)15)5(9)6(4)10/h1H,(H,12,13)(H2,11,14,15)
- InChIKey
- QQNGJNHKOKJXAH-UHFFFAOYSA-N
- Compound name
- 2,3,4-trifluoro-5-sulfamoylbenzoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 255.98859 | 142.6 |
[M+Na]+ | 277.97053 | 153.3 |
[M-H]- | 253.97403 | 141.7 |
[M+NH4]+ | 273.01513 | 159.1 |
[M+K]+ | 293.94447 | 149.4 |
[M+H-H2O]+ | 237.97857 | 134.8 |
[M+HCOO]- | 299.97951 | 156.7 |
[M+CH3COO]- | 313.99516 | 191.1 |
[M+Na-2H]- | 275.95598 | 143.1 |
[M]+ | 254.98076 | 140.7 |
[M]- | 254.98186 | 140.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.