CID 45051165

N-(3-chloro-4-methylphenyl)-n'-(4-phenoxyphenyl)urea

Structural Information

Molecular Formula
C20H17ClN2O2
SMILES
CC1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)Cl
InChI
InChI=1S/C20H17ClN2O2/c1-14-7-8-16(13-19(14)21)23-20(24)22-15-9-11-18(12-10-15)25-17-5-3-2-4-6-17/h2-13H,1H3,(H2,22,23,24)
InChIKey
KFZXMDNWUOXYCL-UHFFFAOYSA-N
Compound name
1-(3-chloro-4-methylphenyl)-3-(4-phenoxyphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.09787 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.10515 184.2
[M+Na]+ 375.08709 200.1
[M+NH4]+ 370.13169 192.7
[M+K]+ 391.06103 190.4
[M-H]- 351.09059 192.2
[M+Na-2H]- 373.07254 195.6
[M]+ 352.09732 189.1
[M]- 352.09842 189.1
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.