CID 459622

93663-71-9

Structural Information

Molecular Formula
C19H17NO4
SMILES
CCOC(=O)C1=C(NC2=C(C1=O)C=C(C=C2)OC)C3=CC=CC=C3
InChI
InChI=1S/C19H17NO4/c1-3-24-19(22)16-17(12-7-5-4-6-8-12)20-15-10-9-13(23-2)11-14(15)18(16)21/h4-11H,3H2,1-2H3,(H,20,21)
InChIKey
OYOCMPYWVOGNFW-UHFFFAOYSA-N
Compound name
ethyl 6-methoxy-4-oxo-2-phenyl-1H-quinoline-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

5
Patents

323.11575 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.123026 174.2
[M+Na]+ 346.104968 183.0
[M-H]- 322.108474 179.6
[M+NH4]+ 341.149573 187.3
[M+K]+ 362.078908 178.2
[M+H-H2O]+ 306.113010 165.1
[M+HCOO]- 368.113951 193.8
[M+CH3COO]- 382.129601 206.7
[M+Na-2H]- 344.090416 178.3
[M]+ 323.11520142 177.4
[M]- 323.11629858 177.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe