CID 299597

2003-42-1

Structural Information

Molecular Formula

C₁₁H₁₃ClN₂O

SMILES

C1CN(C(=O)N1CCCl)C2=CC=CC=C2

InChI

InChI=1S/C11H13ClN2O/c12-6-7-13-8-9-14(11(13)15)10-4-2-1-3-5-10/h1-5H,6-9H2

InChIKey

CPABMYBYUQIWGP-UHFFFAOYSA-N

Compound name

1-(2-chloroethyl)-3-phenylimidazolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 41
Patents: 224.07164 Da
Monoisotopic Mass: 1.7
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]+	225.07892	148.2
[M+Na]+	247.06086	161.6
[M+NH4]+	242.10546	156.7
[M+K]+	263.03480	155.7
[M-H]-	223.06436	150.8
[M+Na-2H]-	245.04631	155.2
[M]+	224.07109	151.0
[M]-	224.07219	151.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe