CID 9667924
4-bromo-2-(2-(phenoxyacetyl)carbohydrazonoyl)phenyl 2-chlorobenzoate
Structural Information
- Molecular Formula
- C22H16BrClN2O4
- SMILES
- C1=CC=C(C=C1)OCC(=O)N/N=C/C2=C(C=CC(=C2)Br)OC(=O)C3=CC=CC=C3Cl
- InChI
- InChI=1S/C22H16BrClN2O4/c23-16-10-11-20(30-22(28)18-8-4-5-9-19(18)24)15(12-16)13-25-26-21(27)14-29-17-6-2-1-3-7-17/h1-13H,14H2,(H,26,27)/b25-13+
- InChIKey
- SSEWVSDECQLDDB-DHRITJCHSA-N
- Compound name
- [4-bromo-2-[(E)-[(2-phenoxyacetyl)hydrazinylidene]methyl]phenyl] 2-chlorobenzoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 487.00548 | 202.3 |
[M+Na]+ | 508.98742 | 210.9 |
[M-H]- | 484.99092 | 214.7 |
[M+NH4]+ | 504.03202 | 213.8 |
[M+K]+ | 524.96136 | 198.1 |
[M+H-H2O]+ | 468.99546 | 198.3 |
[M+HCOO]- | 530.99640 | 220.7 |
[M+CH3COO]- | 545.01205 | 233.7 |
[M+Na-2H]- | 506.97287 | 205.8 |
[M]+ | 485.99765 | 225.5 |
[M]- | 485.99875 | 225.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.