CID 11345546

205058-28-2

Structural Information

Molecular Formula

C₁₄H₁₇N₃O

SMILES

C1CNCCC1N2C=C(NC2=O)C3=CC=CC=C3

InChI

InChI=1S/C14H17N3O/c18-14-16-13(11-4-2-1-3-5-11)10-17(14)12-6-8-15-9-7-12/h1-5,10,12,15H,6-9H2,(H,16,18)

InChIKey

OPCVKWIYGHICKG-UHFFFAOYSA-N

Compound name

5-phenyl-3-piperidin-4-yl-1H-imidazol-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 97
Patents: 243.13716 Da
Monoisotopic Mass: 1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	244.144436	156.3
[M+Na]+	266.126378	162.3
[M-H]-	242.129884	158.9
[M+NH4]+	261.170983	169.3
[M+K]+	282.100318	156.0
[M+H-H2O]+	226.134420	146.5
[M+HCOO]-	288.135361	171.8
[M+CH3COO]-	302.151011	166.0
[M+Na-2H]-	264.111826	158.4
[M]+	243.13661142	148.6
[M]-	243.13770858	148.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe