CID 5364319

6957-22-8

Structural Information

Molecular Formula

C₁₂H₁₀N₄

SMILES

C1=CN=CC=C1/C=N\N=C/C2=CC=NC=C2

InChI

InChI=1S/C12H10N4/c1-5-13-6-2-11(1)9-15-16-10-12-3-7-14-8-4-12/h1-10H/b15-9-,16-10-

InChIKey

XLLIUDMGQNPRJS-VULZFCBJSA-N

Compound name

(Z)-1-pyridin-4-yl-N-[(Z)-pyridin-4-ylmethylideneamino]methanimine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 7
Patents: 210.09055 Da
Monoisotopic Mass: 1.2
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]+	211.09783	145.9
[M+Na]+	233.07977	160.5
[M+NH4]+	228.12437	154.4
[M+K]+	249.05371	151.7
[M-H]-	209.08327	151.3
[M+Na-2H]-	231.06522	157.7
[M]+	210.09000	149.5
[M]-	210.09110	149.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe