CID 4153324

N-cyclohexyl-n'-(cyclohexylmethyl)urea

Structural Information

Molecular Formula
C14H26N2O
SMILES
C1CCC(CC1)CNC(=O)NC2CCCCC2
InChI
InChI=1S/C14H26N2O/c17-14(16-13-9-5-2-6-10-13)15-11-12-7-3-1-4-8-12/h12-13H,1-11H2,(H2,15,16,17)
InChIKey
PMBPKSGAGUUSQE-UHFFFAOYSA-N
Compound name
1-cyclohexyl-3-(cyclohexylmethyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

238.20451 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.21179 160.9
[M+Na]+ 261.19373 167.9
[M+NH4]+ 256.23833 169.1
[M+K]+ 277.16767 161.3
[M-H]- 237.19723 165.3
[M+Na-2H]- 259.17918 165.5
[M]+ 238.20396 162.6
[M]- 238.20506 162.6
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