CID 42553301

228111-37-3

Structural Information

Molecular Formula
C17H21N3O3
SMILES
CCOC(=O)N1CCC(CC1)N2C=C(NC2=O)C3=CC=CC=C3
InChI
InChI=1S/C17H21N3O3/c1-2-23-17(22)19-10-8-14(9-11-19)20-12-15(18-16(20)21)13-6-4-3-5-7-13/h3-7,12,14H,2,8-11H2,1H3,(H,18,21)
InChIKey
RPAJKOOCLQUVJE-UHFFFAOYSA-N
Compound name
ethyl 4-(2-oxo-5-phenyl-1H-imidazol-3-yl)piperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.1583 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.16558 175.4
[M+Na]+ 338.14752 187.0
[M+NH4]+ 333.19212 180.9
[M+K]+ 354.12146 183.1
[M-H]- 314.15102 177.6
[M+Na-2H]- 336.13297 181.2
[M]+ 315.15775 177.3
[M]- 315.15885 177.3
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.