CID 5464234

1005-02-3

Structural Information

Molecular Formula

C₆H₈N₄

SMILES

C1=CC=NC(=C1)/C(=N/N)/N

InChI

InChI=1S/C6H8N4/c7-6(10-8)5-3-1-2-4-9-5/h1-4H,8H2,(H2,7,10)

InChIKey

DKTIHEQAQFSEAB-UHFFFAOYSA-N

Compound name

N'-aminopyridine-2-carboximidamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 129
Patents: 136.07489 Da
Monoisotopic Mass: 0.1
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]+	137.08217	125.6
[M+Na]+	159.06411	132.3
[M-H]-	135.06761	128.6
[M+NH4]+	154.10871	145.1
[M+K]+	175.03805	131.0
[M+H-H2O]+	119.07215	118.3
[M+HCOO]-	181.07309	152.4
[M+CH3COO]-	195.08874	180.2
[M+Na-2H]-	157.04956	133.7
[M]+	136.07434	121.2
[M]-	136.07544	121.2

Literature stripe

literature stripe

Patent stripe

patents stripe