CID 3235606

1-(3-chlorobenzyl)imidazolidin-2-one

Structural Information

Molecular Formula

C₁₀H₁₁ClN₂O

SMILES

C1CN(C(=O)N1)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C10H11ClN2O/c11-9-3-1-2-8(6-9)7-13-5-4-12-10(13)14/h1-3,6H,4-5,7H2,(H,12,14)

InChIKey

BWBAZKSTBCFLBK-UHFFFAOYSA-N

Compound name

1-[(3-chlorophenyl)methyl]imidazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 7
Patents: 210.05598 Da
Monoisotopic Mass: 1.4
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]+	211.06326	144.2
[M+Na]+	233.04520	157.2
[M+NH4]+	228.08980	152.5
[M+K]+	249.01914	151.9
[M-H]-	209.04870	146.2
[M+Na-2H]-	231.03065	150.8
[M]+	210.05543	146.7
[M]-	210.05653	146.7

Literature stripe

literature stripe

Patent stripe

patents stripe