CID 230788

2-(morpholin-4-yl)quinoline-4-carboxylic acid

Structural Information

Molecular Formula
C14H14N2O3
SMILES
C1COCCN1C2=NC3=CC=CC=C3C(=C2)C(=O)O
InChI
InChI=1S/C14H14N2O3/c17-14(18)11-9-13(16-5-7-19-8-6-16)15-12-4-2-1-3-10(11)12/h1-4,9H,5-8H2,(H,17,18)
InChIKey
SXKAHOLXYICUEG-UHFFFAOYSA-N
Compound name
2-morpholin-4-ylquinoline-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

6
Patents

258.10043 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.10771 157.2
[M+Na]+ 281.08965 163.4
[M-H]- 257.09315 160.7
[M+NH4]+ 276.13425 169.6
[M+K]+ 297.06359 160.7
[M+H-H2O]+ 241.09769 147.9
[M+HCOO]- 303.09863 171.6
[M+CH3COO]- 317.11428 167.5
[M+Na-2H]- 279.07510 163.0
[M]+ 258.09988 154.2
[M]- 258.10098 154.2
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.