CID 3066976

80712-48-7

Structural Information

Molecular Formula

C₁₅H₂₈N₄O₂

SMILES

CN(C)C(=O)N(C)C(=O)N1CCN(CC1)C2CCCCC2

InChI

InChI=1S/C15H28N4O2/c1-16(2)14(20)17(3)15(21)19-11-9-18(10-12-19)13-7-5-4-6-8-13/h13H,4-12H2,1-3H3

InChIKey

BFEROYXCEDFPQE-UHFFFAOYSA-N

Compound name

4-cyclohexyl-N-(dimethylcarbamoyl)-N-methylpiperazine-1-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 296.22122 Da
Monoisotopic Mass: 1.1
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]+	297.228496	173.3
[M+Na]+	319.210438	173.1
[M-H]-	295.213944	177.7
[M+NH4]+	314.255043	185.7
[M+K]+	335.184378	173.7
[M+H-H2O]+	279.218480	163.3
[M+HCOO]-	341.219421	188.0
[M+CH3COO]-	355.235071	212.1
[M+Na-2H]-	317.195886	171.5
[M]+	296.22067142	166.7
[M]-	296.22176858	166.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe