CID 1568511

Ethyl4-[(2-hydroxyethyl)amino]-6-methoxy-3-quinolinecarboxylate

Structural Information

Molecular Formula
C15H18N2O4
SMILES
CCOC(=O)C1=CN=C2C=CC(=CC2=C1NCCO)OC
InChI
InChI=1S/C15H18N2O4/c1-3-21-15(19)12-9-17-13-5-4-10(20-2)8-11(13)14(12)16-6-7-18/h4-5,8-9,18H,3,6-7H2,1-2H3,(H,16,17)
InChIKey
GGFUURYMMCWQOI-UHFFFAOYSA-N
Compound name
ethyl 4-(2-hydroxyethylamino)-6-methoxyquinoline-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.12665 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.133926 165.5
[M+Na]+ 313.115868 172.8
[M-H]- 289.119374 167.4
[M+NH4]+ 308.160473 180.1
[M+K]+ 329.089808 170.0
[M+H-H2O]+ 273.123910 157.6
[M+HCOO]- 335.124851 186.1
[M+CH3COO]- 349.140501 203.2
[M+Na-2H]- 311.101316 170.6
[M]+ 290.12610142 169.8
[M]- 290.12719858 169.8
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.