CID 2822865

1-benzyl-3-(3-methoxyphenyl)urea

Structural Information

Molecular Formula
C15H16N2O2
SMILES
COC1=CC=CC(=C1)NC(=O)NCC2=CC=CC=C2
InChI
InChI=1S/C15H16N2O2/c1-19-14-9-5-8-13(10-14)17-15(18)16-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H2,16,17,18)
InChIKey
MEJZUDISYWISBC-UHFFFAOYSA-N
Compound name
1-benzyl-3-(3-methoxyphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

3
Patents

256.1212 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.12848 160.0
[M+Na]+ 279.11042 172.3
[M+NH4]+ 274.15502 167.9
[M+K]+ 295.08436 165.0
[M-H]- 255.11392 165.1
[M+Na-2H]- 277.09587 169.1
[M]+ 256.12065 163.0
[M]- 256.12175 163.0
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

patents stripe