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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.22850 173.3
[M+Na]+ 319.21044 173.1
[M-H]- 295.21394 177.7
[M+NH4]+ 314.25504 185.7
[M+K]+ 335.18438 173.7
[M+H-H2O]+ 279.21848 163.3
[M+HCOO]- 341.21942 188.0
[M+CH3COO]- 355.23507 212.1
[M+Na-2H]- 317.19589 171.5
[M]+ 296.22067 166.7
[M]- 296.22177 166.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe