CID 19794451

2-methoxyquinoline-3-carboxylic acid

Structural Information

Molecular Formula
C11H9NO3
SMILES
COC1=NC2=CC=CC=C2C=C1C(=O)O
InChI
InChI=1S/C11H9NO3/c1-15-10-8(11(13)14)6-7-4-2-3-5-9(7)12-10/h2-6H,1H3,(H,13,14)
InChIKey
SWFGCMGJIYVJFX-UHFFFAOYSA-N
Compound name
2-methoxyquinoline-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

203.05824 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.065516 140.3
[M+Na]+ 226.047458 149.5
[M-H]- 202.050964 142.7
[M+NH4]+ 221.092063 158.5
[M+K]+ 242.021398 146.9
[M+H-H2O]+ 186.055500 133.7
[M+HCOO]- 248.056441 161.1
[M+CH3COO]- 262.072091 183.3
[M+Na-2H]- 224.032906 147.7
[M]+ 203.05769142 142.1
[M]- 203.05878858 142.1
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

patents stripe