CID 459617

5852-78-8

Structural Information

Molecular Formula
C10H7NO3
SMILES
C1=CC2=C(C=CC(=C2N=C1)O)C(=O)O
InChI
InChI=1S/C10H7NO3/c12-8-4-3-7(10(13)14)6-2-1-5-11-9(6)8/h1-5,12H,(H,13,14)
InChIKey
JGRPKOGHYBAVMW-UHFFFAOYSA-N
Compound name
8-hydroxyquinoline-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

41
References

257
Patents

189.04259 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.04987 136.1
[M+Na]+ 212.03181 145.4
[M-H]- 188.03531 137.4
[M+NH4]+ 207.07641 154.3
[M+K]+ 228.00575 142.1
[M+H-H2O]+ 172.03985 130.1
[M+HCOO]- 234.04079 155.8
[M+CH3COO]- 248.05644 177.8
[M+Na-2H]- 210.01726 143.7
[M]+ 189.04204 135.8
[M]- 189.04314 135.8
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