CID 75435

1-(2-chloroethyl)-2-imidazolidinone

Structural Information

Molecular Formula

C₅H₉ClN₂O

SMILES

C1CN(C(=O)N1)CCCl

InChI

InChI=1S/C5H9ClN2O/c6-1-3-8-4-2-7-5(8)9/h1-4H2,(H,7,9)

InChIKey

YGSFFDHIYYOVHV-UHFFFAOYSA-N

Compound name

1-(2-chloroethyl)imidazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 353
Patents: 148.04034 Da
Monoisotopic Mass: -0.1
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]+	149.04762	128.3
[M+Na]+	171.02956	138.8
[M+NH4]+	166.07416	136.0
[M+K]+	187.00350	134.9
[M-H]-	147.03306	127.5
[M+Na-2H]-	169.01501	132.1
[M]+	148.03979	129.4
[M]-	148.04089	129.4

Literature stripe

literature stripe

Patent stripe

patents stripe