CID 3011456

3-fluoro-n-(6-hydroxy-2-pyridyl)benzamide

Structural Information

Molecular Formula

C₁₂H₉FN₂O₂

SMILES

C1=CC(=CC(=C1)F)C(=O)NC2=CC=CC(=O)N2

InChI

InChI=1S/C12H9FN2O2/c13-9-4-1-3-8(7-9)12(17)15-10-5-2-6-11(16)14-10/h1-7H,(H2,14,15,16,17)

InChIKey

VQWUCSFHIXSDPH-UHFFFAOYSA-N

Compound name

3-fluoro-N-(6-oxo-1H-pyridin-2-yl)benzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 232.0648 Da
Monoisotopic Mass: 1.4
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]+	233.072076	147.2
[M+Na]+	255.054018	155.6
[M-H]-	231.057524	150.5
[M+NH4]+	250.098623	162.6
[M+K]+	271.027958	150.9
[M+H-H2O]+	215.062060	138.5
[M+HCOO]-	277.063001	169.3
[M+CH3COO]-	291.078651	188.7
[M+Na-2H]-	253.039466	153.1
[M]+	232.06425142	144.0
[M]-	232.06534858	144.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.