CID 295269

1-(o-chlorophenyl)-3-(p-methoxyphenyl)urea

Structural Information

Molecular Formula
C14H13ClN2O2
SMILES
COC1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2Cl
InChI
InChI=1S/C14H13ClN2O2/c1-19-11-8-6-10(7-9-11)16-14(18)17-13-5-3-2-4-12(13)15/h2-9H,1H3,(H2,16,17,18)
InChIKey
VAEWAKVEKLVFAN-UHFFFAOYSA-N
Compound name
1-(2-chlorophenyl)-3-(4-methoxyphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.06656 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.07384 160.6
[M+Na]+ 299.05578 168.2
[M-H]- 275.05928 167.5
[M+NH4]+ 294.10038 177.0
[M+K]+ 315.02972 163.4
[M+H-H2O]+ 259.06382 153.5
[M+HCOO]- 321.06476 182.2
[M+CH3COO]- 335.08041 200.7
[M+Na-2H]- 297.04123 166.2
[M]+ 276.06601 162.7
[M]- 276.06711 162.7
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.