CID 14977275

143261-63-6

Structural Information

Molecular Formula

C₈H₇N₅

SMILES

C1=CN=CC=C1C2=NC(=NC=N2)N

InChI

InChI=1S/C8H7N5/c9-8-12-5-11-7(13-8)6-1-3-10-4-2-6/h1-5H,(H2,9,11,12,13)

InChIKey

XDOWEJICGSZQCA-UHFFFAOYSA-N

Compound name

4-pyridin-4-yl-1,3,5-triazin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 173.07014 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]+	174.07742	134.6
[M+Na]+	196.05936	149.6
[M+NH4]+	191.10396	142.1
[M+K]+	212.03330	143.1
[M-H]-	172.06286	137.5
[M+Na-2H]-	194.04481	145.0
[M]+	173.06959	137.4
[M]-	173.07069	137.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe