CID 68060
Melicopidine
Structural Information
- Molecular Formula
- C17H15NO5
- SMILES
- CN1C2=CC=CC=C2C(=O)C3=C1C(=C4C(=C3OC)OCO4)OC
- InChI
- InChI=1S/C17H15NO5/c1-18-10-7-5-4-6-9(10)13(19)11-12(18)15(21-3)17-16(14(11)20-2)22-8-23-17/h4-7H,8H2,1-3H3
- InChIKey
- TZZNUDMEMFBPQI-UHFFFAOYSA-N
- Compound name
- 4,11-dimethoxy-5-methyl-[1,3]dioxolo[4,5-b]acridin-10-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 314.10231 | 168.1 |
[M+Na]+ | 336.08425 | 181.3 |
[M-H]- | 312.08775 | 176.2 |
[M+NH4]+ | 331.12885 | 184.5 |
[M+K]+ | 352.05819 | 179.9 |
[M+H-H2O]+ | 296.09229 | 161.0 |
[M+HCOO]- | 358.09323 | 187.7 |
[M+CH3COO]- | 372.10888 | 181.8 |
[M+Na-2H]- | 334.06970 | 175.2 |
[M]+ | 313.09448 | 178.2 |
[M]- | 313.09558 | 178.2 |