CID 10129248

52382-48-6

Structural Information

Molecular Formula

C₁₀H₁₀N₄

SMILES

C1=CC(=NC=C1N)C2=NC=C(C=C2)N

InChI

InChI=1S/C10H10N4/c11-7-1-3-9(13-5-7)10-4-2-8(12)6-14-10/h1-6H,11-12H2

InChIKey

QEIRCDAYPQFYBI-UHFFFAOYSA-N

Compound name

6-(5-amino-2-pyridinyl)pyridin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 277
Patents: 186.09055 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]+	187.097826	139.4
[M+Na]+	209.079768	148.2
[M-H]-	185.083274	143.2
[M+NH4]+	204.124373	155.5
[M+K]+	225.053708	143.8
[M+H-H2O]+	169.087810	130.9
[M+HCOO]-	231.088751	163.4
[M+CH3COO]-	245.104401	152.1
[M+Na-2H]-	207.065216	147.2
[M]+	186.09000142	135.6
[M]-	186.09109858	135.6

Literature stripe

literature stripe

Patent stripe

patents stripe