CID 3508054
Bmh-21
Structural Information
- Molecular Formula
- C21H20N4O2
- SMILES
- CN(C)CCNC(=O)C1=CC=CN2C1=NC3=CC4=CC=CC=C4C=C3C2=O
- InChI
- InChI=1S/C21H20N4O2/c1-24(2)11-9-22-20(26)16-8-5-10-25-19(16)23-18-13-15-7-4-3-6-14(15)12-17(18)21(25)27/h3-8,10,12-13H,9,11H2,1-2H3,(H,22,26)
- InChIKey
- BXYDVWIAGDJBEC-UHFFFAOYSA-N
- Compound name
- N-[2-(dimethylamino)ethyl]-12-oxo-12H-benzo[g]pyrido[2,1-b]quinazoline-4-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 361.16591 | 184.5 |
[M+Na]+ | 383.14785 | 193.3 |
[M-H]- | 359.15135 | 189.6 |
[M+NH4]+ | 378.19245 | 197.3 |
[M+K]+ | 399.12179 | 188.0 |
[M+H-H2O]+ | 343.15589 | 173.7 |
[M+HCOO]- | 405.15683 | 204.8 |
[M+CH3COO]- | 419.17248 | 194.6 |
[M+Na-2H]- | 381.13330 | 193.1 |
[M]+ | 360.15808 | 188.9 |
[M]- | 360.15918 | 188.9 |