CID 466913

Isopropenyl 2-cyano-6-methoxy-2h-quinoline-1-carboxylate

Structural Information

Molecular Formula
C15H14N2O3
SMILES
CC(=C)OC(=O)N1C(C=CC2=C1C=CC(=C2)OC)C#N
InChI
InChI=1S/C15H14N2O3/c1-10(2)20-15(18)17-12(9-16)5-4-11-8-13(19-3)6-7-14(11)17/h4-8,12H,1H2,2-3H3
InChIKey
GJFRGAMPTQWPIA-UHFFFAOYSA-N
Compound name
prop-1-en-2-yl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

270.10043 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.10771 161.7
[M+Na]+ 293.08965 171.7
[M-H]- 269.09315 164.0
[M+NH4]+ 288.13425 176.2
[M+K]+ 309.06359 167.2
[M+H-H2O]+ 253.09769 148.1
[M+HCOO]- 315.09863 177.1
[M+CH3COO]- 329.11428 209.7
[M+Na-2H]- 291.07510 164.2
[M]+ 270.09988 158.7
[M]- 270.10098 158.7
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.