CID 251606

8-hydroxy-2-phenylquinoline-4-carboxylic acid

Structural Information

Molecular Formula
C16H11NO3
SMILES
C1=CC=C(C=C1)C2=NC3=C(C=CC=C3O)C(=C2)C(=O)O
InChI
InChI=1S/C16H11NO3/c18-14-8-4-7-11-12(16(19)20)9-13(17-15(11)14)10-5-2-1-3-6-10/h1-9,18H,(H,19,20)
InChIKey
JRVKMGVIOSRZHR-UHFFFAOYSA-N
Compound name
8-hydroxy-2-phenylquinoline-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

72
Patents

265.07388 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.08116 158.0
[M+Na]+ 288.06310 166.7
[M-H]- 264.06660 162.2
[M+NH4]+ 283.10770 172.6
[M+K]+ 304.03704 161.5
[M+H-H2O]+ 248.07114 150.0
[M+HCOO]- 310.07208 176.8
[M+CH3COO]- 324.08773 169.5
[M+Na-2H]- 286.04855 164.0
[M]+ 265.07333 157.4
[M]- 265.07443 157.4
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.