CID 20193391

6-chloro-3-hydroxyquinoline-4-carboxylic acid

Structural Information

Molecular Formula
C10H6ClNO3
SMILES
C1=CC2=NC=C(C(=C2C=C1Cl)C(=O)O)O
InChI
InChI=1S/C10H6ClNO3/c11-5-1-2-7-6(3-5)9(10(14)15)8(13)4-12-7/h1-4,13H,(H,14,15)
InChIKey
KDQCRVUJRDKQLC-UHFFFAOYSA-N
Compound name
6-chloro-3-hydroxyquinoline-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

223.00362 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.01090 141.9
[M+Na]+ 245.99284 156.7
[M+NH4]+ 241.03744 150.0
[M+K]+ 261.96678 150.7
[M-H]- 221.99634 142.9
[M+Na-2H]- 243.97829 148.0
[M]+ 223.00307 144.5
[M]- 223.00417 144.5
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

patents stripe