CID 24698979

Ethyl 4-chloro-6,8-dimethoxyquinoline-3-carboxylate

Structural Information

Molecular Formula
C14H14ClNO4
SMILES
CCOC(=O)C1=CN=C2C(=CC(=CC2=C1Cl)OC)OC
InChI
InChI=1S/C14H14ClNO4/c1-4-20-14(17)10-7-16-13-9(12(10)15)5-8(18-2)6-11(13)19-3/h5-7H,4H2,1-3H3
InChIKey
DSGVVCRDDXQCTD-UHFFFAOYSA-N
Compound name
ethyl 4-chloro-6,8-dimethoxyquinoline-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.06113 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.06841 162.0
[M+Na]+ 318.05035 176.9
[M+NH4]+ 313.09495 169.5
[M+K]+ 334.02429 170.1
[M-H]- 294.05385 163.5
[M+Na-2H]- 316.03580 167.6
[M]+ 295.06058 164.9
[M]- 295.06168 164.9
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.