CID 2760673

59215-44-0

Structural Information

Molecular Formula

C₇H₁₁N₅

SMILES

C1CN(CCN1)C2=NC=NC=N2

InChI

InChI=1S/C7H11N5/c1-3-12(4-2-8-1)7-10-5-9-6-11-7/h5-6,8H,1-4H2

InChIKey

QKOFSFOOALTCPW-UHFFFAOYSA-N

Compound name

2-piperazin-1-yl-1,3,5-triazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 109
Patents: 165.10144 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]+	166.10872	136.9
[M+Na]+	188.09066	149.6
[M+NH4]+	183.13526	143.8
[M+K]+	204.06460	143.6
[M-H]-	164.09416	137.6
[M+Na-2H]-	186.07611	144.6
[M]+	165.10089	138.6
[M]-	165.10199	138.6

Literature stripe

literature stripe

Patent stripe

patents stripe