CID 15766771

5-(aminomethyl)pyridin-2-amine

Structural Information

Molecular Formula

C₆H₉N₃

SMILES

C1=CC(=NC=C1CN)N

InChI

InChI=1S/C6H9N3/c7-3-5-1-2-6(8)9-4-5/h1-2,4H,3,7H2,(H2,8,9)

InChIKey

PHBVTMQLXNCAQO-UHFFFAOYSA-N

Compound name

5-(aminomethyl)pyridin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 306
Patents: 123.07965 Da
Monoisotopic Mass: -0.5
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]+	124.08693	122.6
[M+Na]+	146.06887	134.2
[M+NH4]+	141.11347	131.2
[M+K]+	162.04281	128.6
[M-H]-	122.07237	125.5
[M+Na-2H]-	144.05432	130.0
[M]+	123.07910	124.8
[M]-	123.08020	124.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe