CID 11355654

Di(1h-imidazol-1-yl)methanimine

Structural Information

Molecular Formula

C₇H₇N₅

SMILES

C1=CN(C=N1)C(=N)N2C=CN=C2

InChI

InChI=1S/C7H7N5/c8-7(11-3-1-9-5-11)12-4-2-10-6-12/h1-6,8H

InChIKey

FKGQRXQOODICAT-UHFFFAOYSA-N

Compound name

di(imidazol-1-yl)methanimine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 413
Patents: 161.07014 Da
Monoisotopic Mass: 0.2
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]+	162.07742	130.6
[M+Na]+	184.05936	142.2
[M+NH4]+	179.10396	137.5
[M+K]+	200.03330	141.0
[M-H]-	160.06286	131.5
[M+Na-2H]-	182.04481	138.8
[M]+	161.06959	132.1
[M]-	161.07069	132.1

Literature stripe

literature stripe

Patent stripe

patents stripe