CID 66547073
Chembl4522563
Structural Information
- Molecular Formula
- C21H17FN2O2S
- SMILES
- C1=CC=C2C(=C1)C=C(N2)S(=O)(=O)NCC3=CC=C(C=C3)C4=CC=C(C=C4)F
- InChI
- InChI=1S/C21H17FN2O2S/c22-19-11-9-17(10-12-19)16-7-5-15(6-8-16)14-23-27(25,26)21-13-18-3-1-2-4-20(18)24-21/h1-13,23-24H,14H2
- InChIKey
- ZYXQIXCJTWOQOB-UHFFFAOYSA-N
- Compound name
- N-[[4-(4-fluorophenyl)phenyl]methyl]-1H-indole-2-sulfonamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 381.10678 | 187.0 |
[M+Na]+ | 403.08872 | 196.9 |
[M-H]- | 379.09222 | 194.7 |
[M+NH4]+ | 398.13332 | 199.8 |
[M+K]+ | 419.06266 | 188.6 |
[M+H-H2O]+ | 363.09676 | 178.0 |
[M+HCOO]- | 425.09770 | 203.8 |
[M+CH3COO]- | 439.11335 | 197.3 |
[M+Na-2H]- | 401.07417 | 191.1 |
[M]+ | 380.09895 | 188.6 |
[M]- | 380.10005 | 188.6 |
Literature stripe
Patent stripe
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