CID 3720743

N-(2-chlorobenzoyl)-n'-(3-chlorophenyl)urea

Structural Information

Molecular Formula
C14H10Cl2N2O2
SMILES
C1=CC=C(C(=C1)C(=O)NC(=O)NC2=CC(=CC=C2)Cl)Cl
InChI
InChI=1S/C14H10Cl2N2O2/c15-9-4-3-5-10(8-9)17-14(20)18-13(19)11-6-1-2-7-12(11)16/h1-8H,(H2,17,18,19,20)
InChIKey
CZCLUFTWCXPFOV-UHFFFAOYSA-N
Compound name
2-chloro-N-[(3-chlorophenyl)carbamoyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.01193 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.01921 166.1
[M+Na]+ 331.00115 174.2
[M-H]- 307.00465 172.4
[M+NH4]+ 326.04575 181.6
[M+K]+ 346.97509 168.1
[M+H-H2O]+ 291.00919 160.1
[M+HCOO]- 353.01013 181.8
[M+CH3COO]- 367.02578 204.5
[M+Na-2H]- 328.98660 169.8
[M]+ 308.01138 168.4
[M]- 308.01248 168.4
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.