CID 4118809
3-nitro-n-(2-((3-nitrobenzoyl)amino)phenyl)benzamide
Structural Information
- Molecular Formula
- C20H14N4O6
- SMILES
- C1=CC=C(C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]
- InChI
- InChI=1S/C20H14N4O6/c25-19(13-5-3-7-15(11-13)23(27)28)21-17-9-1-2-10-18(17)22-20(26)14-6-4-8-16(12-14)24(29)30/h1-12H,(H,21,25)(H,22,26)
- InChIKey
- LPHUJMSALIIJJN-UHFFFAOYSA-N
- Compound name
- 3-nitro-N-[2-[(3-nitrobenzoyl)amino]phenyl]benzamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 407.09862 | 189.6 |
[M+Na]+ | 429.08056 | 190.3 |
[M-H]- | 405.08406 | 198.2 |
[M+NH4]+ | 424.12516 | 195.7 |
[M+K]+ | 445.05450 | 179.1 |
[M+H-H2O]+ | 389.08860 | 187.3 |
[M+HCOO]- | 451.08954 | 214.1 |
[M+CH3COO]- | 465.10519 | 214.6 |
[M+Na-2H]- | 427.06601 | 196.5 |
[M]+ | 406.09079 | 184.5 |
[M]- | 406.09189 | 184.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.