CID 3580939

1-(4-acetamidophenyl)-3-(2-methoxyphenyl)urea

Structural Information

Molecular Formula
C16H17N3O3
SMILES
CC(=O)NC1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2OC
InChI
InChI=1S/C16H17N3O3/c1-11(20)17-12-7-9-13(10-8-12)18-16(21)19-14-5-3-4-6-15(14)22-2/h3-10H,1-2H3,(H,17,20)(H2,18,19,21)
InChIKey
NQALBQSEABVSKK-UHFFFAOYSA-N
Compound name
N-[4-[(2-methoxyphenyl)carbamoylamino]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

299.12698 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.134256 168.6
[M+Na]+ 322.116198 173.5
[M-H]- 298.119704 175.4
[M+NH4]+ 317.160803 182.5
[M+K]+ 338.090138 170.9
[M+H-H2O]+ 282.124240 159.8
[M+HCOO]- 344.125181 194.4
[M+CH3COO]- 358.140831 210.0
[M+Na-2H]- 320.101646 173.0
[M]+ 299.12643142 168.4
[M]- 299.12752858 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

patents stripe