CID 5494824
Grandisine iii
Structural Information
- Molecular Formula
- C15H13NO5
- SMILES
- CN1C2=C(C(=CC(=C2)O)O)C(=O)C3=C1C(=C(C=C3)O)OC
- InChI
- InChI=1S/C15H13NO5/c1-16-9-5-7(17)6-11(19)12(9)14(20)8-3-4-10(18)15(21-2)13(8)16/h3-6,17-19H,1-2H3
- InChIKey
- QNXGBYOUHGRJCI-UHFFFAOYSA-N
- Compound name
- 1,3,6-trihydroxy-5-methoxy-10-methylacridin-9-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 288.08666 | 161.2 |
[M+Na]+ | 310.06860 | 174.3 |
[M-H]- | 286.07210 | 163.6 |
[M+NH4]+ | 305.11320 | 176.8 |
[M+K]+ | 326.04254 | 169.7 |
[M+H-H2O]+ | 270.07664 | 154.5 |
[M+HCOO]- | 332.07758 | 179.7 |
[M+CH3COO]- | 346.09323 | 198.7 |
[M+Na-2H]- | 308.05405 | 167.3 |
[M]+ | 287.07883 | 166.5 |
[M]- | 287.07993 | 166.5 |
Literature stripe
Patent stripe
No patent data available for this compound.