CID 3009688

Methyl 6-methoxy-5,10-dioxo-1,4-dihydrobenzo[g]quinoline-4-carboxylate

Structural Information

Molecular Formula
C16H13NO5
SMILES
COC1=CC=CC2=C1C(=O)C3=C(C2=O)NC=CC3C(=O)OC
InChI
InChI=1S/C16H13NO5/c1-21-10-5-3-4-8-11(10)15(19)12-9(16(20)22-2)6-7-17-13(12)14(8)18/h3-7,9,17H,1-2H3
InChIKey
XAGBWJKEPPELTI-UHFFFAOYSA-N
Compound name
methyl 6-methoxy-5,10-dioxo-1,4-dihydrobenzo[g]quinoline-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

299.07938 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.08666 163.8
[M+Na]+ 322.06860 172.9
[M-H]- 298.07210 166.8
[M+NH4]+ 317.11320 179.2
[M+K]+ 338.04254 169.3
[M+H-H2O]+ 282.07664 156.3
[M+HCOO]- 344.07758 180.2
[M+CH3COO]- 358.09323 203.1
[M+Na-2H]- 320.05405 167.9
[M]+ 299.07883 165.8
[M]- 299.07993 165.8
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.