CID 826935

2-fluoro-n-(pyridin-2-yl)benzamide

Structural Information

Molecular Formula

C₁₂H₉FN₂O

SMILES

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

InChI

InChI=1S/C12H9FN2O/c13-10-6-2-1-5-9(10)12(16)15-11-7-3-4-8-14-11/h1-8H,(H,14,15,16)

InChIKey

IJJJNANXLBDKDV-UHFFFAOYSA-N

Compound name

2-fluoro-N-pyridin-2-ylbenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 13
Patents: 216.06989 Da
Monoisotopic Mass: 2.1
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]+	217.077166	144.4
[M+Na]+	239.059108	152.1
[M-H]-	215.062614	148.6
[M+NH4]+	234.103713	160.9
[M+K]+	255.033048	148.2
[M+H-H2O]+	199.067150	135.3
[M+HCOO]-	261.068091	167.5
[M+CH3COO]-	275.083741	188.7
[M+Na-2H]-	237.044556	151.5
[M]+	216.06934142	141.9
[M]-	216.07043858	141.9

Literature stripe

literature stripe

Patent stripe

patents stripe