CID 4072297
N-{3-[{3-[benzyl(methyl)amino]propyl}(methyl)amino]propyl}-3-bromo-4-ethoxybenzamide
Structural Information
- Molecular Formula
- C24H34BrN3O2
- SMILES
- CCOC1=C(C=C(C=C1)C(=O)NCCCN(C)CCCN(C)CC2=CC=CC=C2)Br
- InChI
- InChI=1S/C24H34BrN3O2/c1-4-30-23-13-12-21(18-22(23)25)24(29)26-14-8-15-27(2)16-9-17-28(3)19-20-10-6-5-7-11-20/h5-7,10-13,18H,4,8-9,14-17,19H2,1-3H3,(H,26,29)
- InChIKey
- RQAJEDKYVHJCLC-UHFFFAOYSA-N
- Compound name
- N-[3-[3-[benzyl(methyl)amino]propyl-methylamino]propyl]-3-bromo-4-ethoxybenzamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 476.19072 | 212.1 |
[M+Na]+ | 498.17266 | 215.9 |
[M-H]- | 474.17616 | 221.4 |
[M+NH4]+ | 493.21726 | 223.6 |
[M+K]+ | 514.14660 | 204.7 |
[M+H-H2O]+ | 458.18070 | 206.2 |
[M+HCOO]- | 520.18164 | 233.3 |
[M+CH3COO]- | 534.19729 | 245.0 |
[M+Na-2H]- | 496.15811 | 212.3 |
[M]+ | 475.18289 | 234.7 |
[M]- | 475.18399 | 234.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.