CID 9588181
Brn 0824360
Structural Information
- Molecular Formula
- C16H20N4O2
- SMILES
- CN1CCN(CC1)CC(=O)N/N=C/C2=CC3=CC=CC=C3O2
- InChI
- InChI=1S/C16H20N4O2/c1-19-6-8-20(9-7-19)12-16(21)18-17-11-14-10-13-4-2-3-5-15(13)22-14/h2-5,10-11H,6-9,12H2,1H3,(H,18,21)/b17-11+
- InChIKey
- LVBJWUSNWCGBPO-GZTJUZNOSA-N
- Compound name
- N-[(E)-1-benzofuran-2-ylmethylideneamino]-2-(4-methylpiperazin-1-yl)acetamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 301.16591 | 169.5 |
[M+Na]+ | 323.14785 | 175.4 |
[M-H]- | 299.15135 | 175.9 |
[M+NH4]+ | 318.19245 | 183.1 |
[M+K]+ | 339.12179 | 172.6 |
[M+H-H2O]+ | 283.15589 | 159.7 |
[M+HCOO]- | 345.15683 | 190.7 |
[M+CH3COO]- | 359.17248 | 208.5 |
[M+Na-2H]- | 321.13330 | 174.4 |
[M]+ | 300.15808 | 169.5 |
[M]- | 300.15918 | 169.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.