CID 84566

1,3-dipiperidinourea

Structural Information

Molecular Formula

C₁₁H₂₂N₄O

SMILES

C1CCN(CC1)NC(=O)NN2CCCCC2

InChI

InChI=1S/C11H22N4O/c16-11(12-14-7-3-1-4-8-14)13-15-9-5-2-6-10-15/h1-10H2,(H2,12,13,16)

InChIKey

MTQTYGHVBJMNPG-UHFFFAOYSA-N

Compound name

1,3-di(piperidin-1-yl)urea

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 11
Patents: 226.17937 Da
Monoisotopic Mass: 1.5
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]+	227.18665	155.0
[M+Na]+	249.16859	162.1
[M+NH4]+	244.21319	162.0
[M+K]+	265.14253	156.8
[M-H]-	225.17209	157.7
[M+Na-2H]-	247.15404	159.5
[M]+	226.17882	156.2
[M]-	226.17992	156.2

Literature stripe

literature stripe

Patent stripe

patents stripe