CID 215377

35629-54-0

Structural Information

Molecular Formula
C18H17N3O2
SMILES
CCNC(=O)NC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H17N3O2/c1-2-19-17(22)21-18-20-15(13-9-5-3-6-10-13)16(23-18)14-11-7-4-8-12-14/h3-12H,2H2,1H3,(H2,19,20,21,22)
InChIKey
FFMFKSDUIGJKCC-UHFFFAOYSA-N
Compound name
1-(4,5-diphenyl-1,3-oxazol-2-yl)-3-ethylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.13208 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.139356 171.9
[M+Na]+ 330.121298 178.1
[M-H]- 306.124804 181.3
[M+NH4]+ 325.165903 184.7
[M+K]+ 346.095238 174.6
[M+H-H2O]+ 290.129340 162.3
[M+HCOO]- 352.130281 196.5
[M+CH3COO]- 366.145931 183.2
[M+Na-2H]- 328.106746 176.6
[M]+ 307.13153142 172.4
[M]- 307.13262858 172.4
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