CID 368567
Nsc639660
Structural Information
- Molecular Formula
- C16H12N2O5
- SMILES
- COC(=O)C1=C2C3=CC=CC=C3NC(=O)C2=CN=C1C(=O)OC
- InChI
- InChI=1S/C16H12N2O5/c1-22-15(20)12-11-8-5-3-4-6-10(8)18-14(19)9(11)7-17-13(12)16(21)23-2/h3-7H,1-2H3,(H,18,19)
- InChIKey
- GKTOKONRTOOZNN-UHFFFAOYSA-N
- Compound name
- dimethyl 5-oxo-6H-benzo[f][2,7]naphthyridine-1,2-dicarboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 313.08190 | 167.2 |
[M+Na]+ | 335.06384 | 178.0 |
[M-H]- | 311.06734 | 169.7 |
[M+NH4]+ | 330.10844 | 180.6 |
[M+K]+ | 351.03778 | 174.1 |
[M+H-H2O]+ | 295.07188 | 158.6 |
[M+HCOO]- | 357.07282 | 185.5 |
[M+CH3COO]- | 371.08847 | 203.9 |
[M+Na-2H]- | 333.04929 | 173.6 |
[M]+ | 312.07407 | 172.7 |
[M]- | 312.07517 | 172.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.