CID 1477845

439108-84-6

Structural Information

Molecular Formula

C₁₂H₁₀N₄

SMILES

C1=CC(=CC(=C1)N)C2=CN3C=CC=NC3=N2

InChI

InChI=1S/C12H10N4/c13-10-4-1-3-9(7-10)11-8-16-6-2-5-14-12(16)15-11/h1-8H,13H2

InChIKey

HUUWWGMUBHRQMS-UHFFFAOYSA-N

Compound name

3-imidazo[1,2-a]pyrimidin-2-ylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 9
Patents: 210.09055 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]+	211.09783	143.8
[M+Na]+	233.07977	159.5
[M+NH4]+	228.12437	152.6
[M+K]+	249.05371	153.7
[M-H]-	209.08327	148.0
[M+Na-2H]-	231.06522	153.9
[M]+	210.09000	147.3
[M]-	210.09110	147.3

Literature stripe

literature stripe

Patent stripe

patents stripe