CID 4610950
2,2-diphenyl-n-(2,2,2-trichloro-1-(4-iodoanilino)ethyl)acetamide
Structural Information
- Molecular Formula
- C22H18Cl3IN2O
- SMILES
- C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC(C(Cl)(Cl)Cl)NC3=CC=C(C=C3)I
- InChI
- InChI=1S/C22H18Cl3IN2O/c23-22(24,25)21(27-18-13-11-17(26)12-14-18)28-20(29)19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14,19,21,27H,(H,28,29)
- InChIKey
- BFNWWOURRWXXCO-UHFFFAOYSA-N
- Compound name
- 2,2-diphenyl-N-[2,2,2-trichloro-1-(4-iodoanilino)ethyl]acetamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 558.96022 | 210.8 |
[M+Na]+ | 580.94216 | 208.5 |
[M-H]- | 556.94566 | 210.1 |
[M+NH4]+ | 575.98676 | 215.4 |
[M+K]+ | 596.91610 | 206.5 |
[M+H-H2O]+ | 540.95020 | 199.4 |
[M+HCOO]- | 602.95114 | 212.3 |
[M+CH3COO]- | 616.96679 | 235.2 |
[M+Na-2H]- | 578.92761 | 200.8 |
[M]+ | 557.95239 | 209.6 |
[M]- | 557.95349 | 209.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.