CID 844453

N-cyclohexyl-n'-[4-(dimethylamino)phenyl]urea

Structural Information

Molecular Formula
C15H23N3O
SMILES
CN(C)C1=CC=C(C=C1)NC(=O)NC2CCCCC2
InChI
InChI=1S/C15H23N3O/c1-18(2)14-10-8-13(9-11-14)17-15(19)16-12-6-4-3-5-7-12/h8-12H,3-7H2,1-2H3,(H2,16,17,19)
InChIKey
IXWUMQXBWDIOGQ-UHFFFAOYSA-N
Compound name
1-cyclohexyl-3-[4-(dimethylamino)phenyl]urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

24
Patents

261.1841 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.19138 162.1
[M+Na]+ 284.17332 163.7
[M-H]- 260.17682 168.8
[M+NH4]+ 279.21792 177.9
[M+K]+ 300.14726 162.1
[M+H-H2O]+ 244.18136 153.5
[M+HCOO]- 306.18230 184.8
[M+CH3COO]- 320.19795 206.3
[M+Na-2H]- 282.15877 165.1
[M]+ 261.18355 156.6
[M]- 261.18465 156.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe