CID 307095

1-benzyl-1-ethyl-3-phenylurea

Structural Information

Molecular Formula
C16H18N2O
SMILES
CCN(CC1=CC=CC=C1)C(=O)NC2=CC=CC=C2
InChI
InChI=1S/C16H18N2O/c1-2-18(13-14-9-5-3-6-10-14)16(19)17-15-11-7-4-8-12-15/h3-12H,2,13H2,1H3,(H,17,19)
InChIKey
SBNLPMZMXJQOMF-UHFFFAOYSA-N
Compound name
1-benzyl-1-ethyl-3-phenylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

254.1419 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.14918 161.3
[M+Na]+ 277.13112 173.7
[M+NH4]+ 272.17572 169.8
[M+K]+ 293.10506 165.9
[M-H]- 253.13462 167.2
[M+Na-2H]- 275.11657 171.1
[M]+ 254.14135 164.6
[M]- 254.14245 164.6
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