CID 2758651

22746-09-4

Structural Information

Molecular Formula

C₁₀H₁₆N₄

SMILES

CC1=CC(=NC(=N1)N2CCNCC2)C

InChI

InChI=1S/C10H16N4/c1-8-7-9(2)13-10(12-8)14-5-3-11-4-6-14/h7,11H,3-6H2,1-2H3

InChIKey

QLTXFTSBONWMPM-UHFFFAOYSA-N

Compound name

4,6-dimethyl-2-piperazin-1-ylpyrimidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 83
Patents: 192.1375 Da
Monoisotopic Mass: 0.8
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]+	193.14478	145.9
[M+Na]+	215.12672	159.1
[M+NH4]+	210.17132	153.2
[M+K]+	231.10066	152.5
[M-H]-	191.13022	147.6
[M+Na-2H]-	213.11217	152.9
[M]+	192.13695	148.1
[M]-	192.13805	148.1

Literature stripe

literature stripe

Patent stripe

patents stripe