CID 10610607

3-bromo-n-phenylpyridin-2-amine

Structural Information

Molecular Formula

C₁₁H₉BrN₂

SMILES

C1=CC=C(C=C1)NC2=C(C=CC=N2)Br

InChI

InChI=1S/C11H9BrN2/c12-10-7-4-8-13-11(10)14-9-5-2-1-3-6-9/h1-8H,(H,13,14)

InChIKey

ZBEQUCPZBWLXOI-UHFFFAOYSA-N

Compound name

3-bromo-N-phenylpyridin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 35
Patents: 247.9949 Da
Monoisotopic Mass: 3.4
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]+	249.00218	145.2
[M+Na]+	270.98412	150.8
[M+NH4]+	266.02872	151.1
[M+K]+	286.95806	148.9
[M-H]-	246.98762	148.8
[M+Na-2H]-	268.96957	152.7
[M]+	247.99435	146.0
[M]-	247.99545	146.0

Literature stripe

literature stripe

Patent stripe

patents stripe