CID 86566705
[1,1'-biphenyl]-4-sulfonamide, 4'-chloro-2'-cyano-n-(trans-4-hydroxy-4-methylcyclohexyl)-
Structural Information
- Molecular Formula
- C20H21ClN2O3S
- SMILES
- CC1(CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)C3=C(C=C(C=C3)Cl)C#N)O
- InChI
- InChI=1S/C20H21ClN2O3S/c1-20(24)10-8-17(9-11-20)23-27(25,26)18-5-2-14(3-6-18)19-7-4-16(21)12-15(19)13-22/h2-7,12,17,23-24H,8-11H2,1H3
- InChIKey
- PHOYDFRXZMNHIF-UHFFFAOYSA-N
- Compound name
- 4-(4-chloro-2-cyanophenyl)-N-(4-hydroxy-4-methylcyclohexyl)benzenesulfonamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 405.10341 | 203.5 |
[M+Na]+ | 427.08535 | 213.6 |
[M-H]- | 403.08885 | 210.5 |
[M+NH4]+ | 422.12995 | 215.4 |
[M+K]+ | 443.05929 | 204.6 |
[M+H-H2O]+ | 387.09339 | 190.9 |
[M+HCOO]- | 449.09433 | 209.9 |
[M+CH3COO]- | 463.10998 | 225.8 |
[M+Na-2H]- | 425.07080 | 204.1 |
[M]+ | 404.09558 | 199.0 |
[M]- | 404.09668 | 199.0 |
Literature stripe
No literature data available for this compound.