CID 3753055

N-(5-chloro-2-methoxyphenyl)-n'-(3-chlorophenyl)urea

Structural Information

Molecular Formula
C14H12Cl2N2O2
SMILES
COC1=C(C=C(C=C1)Cl)NC(=O)NC2=CC(=CC=C2)Cl
InChI
InChI=1S/C14H12Cl2N2O2/c1-20-13-6-5-10(16)8-12(13)18-14(19)17-11-4-2-3-9(15)7-11/h2-8H,1H3,(H2,17,18,19)
InChIKey
RWJMFVKTBCCTAR-UHFFFAOYSA-N
Compound name
1-(5-chloro-2-methoxyphenyl)-3-(3-chlorophenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

310.0276 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.03488 167.0
[M+Na]+ 333.01682 175.9
[M-H]- 309.02032 173.4
[M+NH4]+ 328.06142 182.8
[M+K]+ 348.99076 169.9
[M+H-H2O]+ 293.02486 160.9
[M+HCOO]- 355.02580 183.4
[M+CH3COO]- 369.04145 206.2
[M+Na-2H]- 331.00227 171.1
[M]+ 310.02705 170.9
[M]- 310.02815 170.9
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.