CID 887881

N-(3-chlorophenyl)-n'-(4-phenoxyphenyl)urea

Structural Information

Molecular Formula
C19H15ClN2O2
SMILES
C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)NC3=CC(=CC=C3)Cl
InChI
InChI=1S/C19H15ClN2O2/c20-14-5-4-6-16(13-14)22-19(23)21-15-9-11-18(12-10-15)24-17-7-2-1-3-8-17/h1-13H,(H2,21,22,23)
InChIKey
NKWFPJQFNKTLNE-UHFFFAOYSA-N
Compound name
1-(3-chlorophenyl)-3-(4-phenoxyphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.0822 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.08948 177.3
[M+Na]+ 361.07142 184.0
[M-H]- 337.07492 186.8
[M+NH4]+ 356.11602 190.5
[M+K]+ 377.04536 177.7
[M+H-H2O]+ 321.07946 168.4
[M+HCOO]- 383.08040 198.4
[M+CH3COO]- 397.09605 188.1
[M+Na-2H]- 359.05687 182.9
[M]+ 338.08165 178.8
[M]- 338.08275 178.8
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.