CID 24067

7482-91-9

Structural Information

Molecular Formula

C₁₅H₁₀N₂O₂

SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C15H10N2O2/c18-15(19)12-8-14(10-4-3-7-16-9-10)17-13-6-2-1-5-11(12)13/h1-9H,(H,18,19)

InChIKey

XQNXXNNXRWYNAS-UHFFFAOYSA-N

Compound name

2-pyridin-3-ylquinoline-4-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 27
Patents: 250.07423 Da
Monoisotopic Mass: 2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	251.08151	155.2
[M+Na]+	273.06345	171.5
[M+NH4]+	268.10805	163.5
[M+K]+	289.03739	163.9
[M-H]-	249.06695	159.0
[M+Na-2H]-	271.04890	164.8
[M]+	250.07368	158.7
[M]-	250.07478	158.7

Literature stripe

literature stripe

Patent stripe

patents stripe