CID 841429

10080-05-4

Structural Information

Molecular Formula
C15H23N3O3S
SMILES
C1CCC(CC1)NC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N
InChI
InChI=1S/C15H23N3O3S/c16-22(20,21)14-8-6-12(7-9-14)10-11-17-15(19)18-13-4-2-1-3-5-13/h6-9,13H,1-5,10-11H2,(H2,16,20,21)(H2,17,18,19)
InChIKey
NIMGDPRCIUIRNT-UHFFFAOYSA-N
Compound name
1-cyclohexyl-3-[2-(4-sulfamoylphenyl)ethyl]urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

0
Patents

325.14603 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.15331 172.8
[M+Na]+ 348.13525 179.2
[M+NH4]+ 343.17985 178.7
[M+K]+ 364.10919 173.1
[M-H]- 324.13875 175.7
[M+Na-2H]- 346.12070 177.6
[M]+ 325.14548 174.4
[M]- 325.14658 174.4
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

No patent data available for this compound.