CID 3070394

N-(3-chlorophenyl)-n'-(3-ethoxy-2-(4-morpholinyl)propyl)urea

Structural Information

Molecular Formula
C16H24ClN3O3
SMILES
CCOCC(CNC(=O)NC1=CC(=CC=C1)Cl)N2CCOCC2
InChI
InChI=1S/C16H24ClN3O3/c1-2-22-12-15(20-6-8-23-9-7-20)11-18-16(21)19-14-5-3-4-13(17)10-14/h3-5,10,15H,2,6-9,11-12H2,1H3,(H2,18,19,21)
InChIKey
VUOAKPMTWRKOCA-UHFFFAOYSA-N
Compound name
1-(3-chlorophenyl)-3-(3-ethoxy-2-morpholin-4-ylpropyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.1506 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.15788 181.4
[M+Na]+ 364.13982 183.7
[M-H]- 340.14332 185.6
[M+NH4]+ 359.18442 191.7
[M+K]+ 380.11376 181.0
[M+H-H2O]+ 324.14786 172.4
[M+HCOO]- 386.14880 194.9
[M+CH3COO]- 400.16445 212.4
[M+Na-2H]- 362.12527 183.5
[M]+ 341.15005 181.4
[M]- 341.15115 181.4
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

No patent data available for this compound.