CID 9589523
116990-06-8
Structural Information
- Molecular Formula
- C24H16BrClN6O3
- SMILES
- C/C(=N\NC(=O)CN1C2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4N=C31)/C5=C(C=C(C=C5)[N+](=O)[O-])Br
- InChI
- InChI=1S/C24H16BrClN6O3/c1-13(16-8-7-15(32(34)35)11-18(16)25)29-30-22(33)12-31-21-9-6-14(26)10-17(21)23-24(31)28-20-5-3-2-4-19(20)27-23/h2-11H,12H2,1H3,(H,30,33)/b29-13+
- InChIKey
- ZQURETDCBXFMMV-VFLNYLIXSA-N
- Compound name
- N-[(E)-1-(2-bromo-4-nitrophenyl)ethylideneamino]-2-(9-chloroindolo[3,2-b]quinoxalin-6-yl)acetamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 551.02284 | 217.0 |
[M+Na]+ | 573.00478 | 226.8 |
[M-H]- | 549.00828 | 226.3 |
[M+NH4]+ | 568.04938 | 225.9 |
[M+K]+ | 588.97872 | 209.9 |
[M+H-H2O]+ | 533.01282 | 215.9 |
[M+HCOO]- | 595.01376 | 231.6 |
[M+CH3COO]- | 609.02941 | 242.9 |
[M+Na-2H]- | 570.99023 | 225.2 |
[M]+ | 550.01501 | 240.5 |
[M]- | 550.01611 | 240.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.