CID 3009690

Methyl 6-hydroxy-5,10-dioxo-benzo[g]quinoline-4-carboxylate

Structural Information

Molecular Formula
C15H9NO5
SMILES
COC(=O)C1=C2C(=NC=C1)C(=O)C3=C(C2=O)C(=CC=C3)O
InChI
InChI=1S/C15H9NO5/c1-21-15(20)8-5-6-16-12-11(8)14(19)10-7(13(12)18)3-2-4-9(10)17/h2-6,17H,1H3
InChIKey
RDTAFZPSORTSPD-UHFFFAOYSA-N
Compound name
methyl 6-hydroxy-5,10-dioxobenzo[g]quinoline-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

283.04807 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.05535 158.1
[M+Na]+ 306.03729 168.7
[M-H]- 282.04079 161.8
[M+NH4]+ 301.08189 174.3
[M+K]+ 322.01123 165.2
[M+H-H2O]+ 266.04533 150.8
[M+HCOO]- 328.04627 176.4
[M+CH3COO]- 342.06192 199.7
[M+Na-2H]- 304.02274 163.8
[M]+ 283.04752 161.2
[M]- 283.04862 161.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.