CID 22018862

2-aminoquinoline-6-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C10H8N2O2
SMILES
C1=CC2=C(C=CC(=N2)N)C=C1C(=O)O
InChI
InChI=1S/C10H8N2O2/c11-9-4-2-6-5-7(10(13)14)1-3-8(6)12-9/h1-5H,(H2,11,12)(H,13,14)
InChIKey
RGFNYRASTCKUCA-UHFFFAOYSA-N
Compound name
2-aminoquinoline-6-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

81
Patents

188.05858 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.065856 137.2
[M+Na]+ 211.047798 146.1
[M-H]- 187.051304 139.2
[M+NH4]+ 206.092403 155.5
[M+K]+ 227.021738 142.7
[M+H-H2O]+ 171.055840 130.7
[M+HCOO]- 233.056781 158.5
[M+CH3COO]- 247.072431 182.6
[M+Na-2H]- 209.033246 144.5
[M]+ 188.05803142 135.5
[M]- 188.05912858 135.5
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