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]+ 271.107706 161.7
[M+Na]+ 293.089648 171.7
[M-H]- 269.093154 164.0
[M+NH4]+ 288.134253 176.2
[M+K]+ 309.063588 167.2
[M+H-H2O]+ 253.097690 148.1
[M+HCOO]- 315.098631 177.1
[M+CH3COO]- 329.114281 209.7
[M+Na-2H]- 291.075096 164.2
[M]+ 270.09988142 158.7
[M]- 270.10097858 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.