CID 286689

32889-94-4

Structural Information

Molecular Formula
C19H16N2O4
SMILES
CCOC(=O)C1=C(C=C2C3=NC4=CC=CC=C4C=C3CN2C1=O)OC
InChI
InChI=1S/C19H16N2O4/c1-3-25-19(23)16-15(24-2)9-14-17-12(10-21(14)18(16)22)8-11-6-4-5-7-13(11)20-17/h4-9H,3,10H2,1-2H3
InChIKey
QXEKBRFTLMLECO-UHFFFAOYSA-N
Compound name
ethyl 7-methoxy-9-oxo-11H-indolizino[1,2-b]quinoline-8-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.111 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.11828 177.5
[M+Na]+ 359.10022 188.4
[M-H]- 335.10372 182.1
[M+NH4]+ 354.14482 193.6
[M+K]+ 375.07416 183.7
[M+H-H2O]+ 319.10826 168.9
[M+HCOO]- 381.10920 195.9
[M+CH3COO]- 395.12485 189.0
[M+Na-2H]- 357.08567 181.9
[M]+ 336.11045 184.2
[M]- 336.11155 184.2
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

No patent data available for this compound.