CID 204417

16268-88-5

Structural Information

Molecular Formula

C₁₃H₂₂N₆

SMILES

C1CCN(CC1)C2=NC(=NC(=N2)N)N3CCCCC3

InChI

InChI=1S/C13H22N6/c14-11-15-12(18-7-3-1-4-8-18)17-13(16-11)19-9-5-2-6-10-19/h1-10H2,(H2,14,15,16,17)

InChIKey

ASSKKCTXCCCXLQ-UHFFFAOYSA-N

Compound name

4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 1
Patents: 262.19058 Da
Monoisotopic Mass: 2.2
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]+	263.19786	166.9
[M+Na]+	285.17980	170.2
[M-H]-	261.18330	167.4
[M+NH4]+	280.22440	175.0
[M+K]+	301.15374	165.1
[M+H-H2O]+	245.18784	154.0
[M+HCOO]-	307.18878	177.7
[M+CH3COO]-	321.20443	173.9
[M+Na-2H]-	283.16525	169.7
[M]+	262.19003	156.0
[M]-	262.19113	156.0

Literature stripe

literature stripe

Patent stripe

patents stripe