CID 71738890
Schembl15276018
Structural Information
- Molecular Formula
- C19H25N7O2
- SMILES
- CCOC1=CN=C(N=C1)NCC2=CC3=C(N=C2N4CCOCC4)N(N=C3C)C
- InChI
- InChI=1S/C19H25N7O2/c1-4-28-15-11-21-19(22-12-15)20-10-14-9-16-13(2)24-25(3)18(16)23-17(14)26-5-7-27-8-6-26/h9,11-12H,4-8,10H2,1-3H3,(H,20,21,22)
- InChIKey
- XMGPQSFXHUQCHL-UHFFFAOYSA-N
- Compound name
- N-[(1,3-dimethyl-6-morpholin-4-ylpyrazolo[3,4-b]pyridin-5-yl)methyl]-5-ethoxypyrimidin-2-amine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 384.21425 | 196.4 |
[M+Na]+ | 406.19619 | 204.9 |
[M-H]- | 382.19969 | 200.0 |
[M+NH4]+ | 401.24079 | 200.8 |
[M+K]+ | 422.17013 | 199.1 |
[M+H-H2O]+ | 366.20423 | 183.0 |
[M+HCOO]- | 428.20517 | 209.9 |
[M+CH3COO]- | 442.22082 | 204.0 |
[M+Na-2H]- | 404.18164 | 198.7 |
[M]+ | 383.20642 | 198.6 |
[M]- | 383.20752 | 198.6 |
Literature stripe
No literature data available for this compound.