CID 11229265

41730-71-6

Structural Information

Molecular Formula

C₆H₇ClN₂O₃

SMILES

CC(=O)N1CCN(C1=O)C(=O)Cl

InChI

InChI=1S/C6H7ClN2O3/c1-4(10)8-2-3-9(5(7)11)6(8)12/h2-3H2,1H3

InChIKey

CCRQBNJTBJRTJD-UHFFFAOYSA-N

Compound name

3-acetyl-2-oxoimidazolidine-1-carbonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 41
Patents: 190.01453 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]+	191.02181	136.4
[M+Na]+	213.00375	146.2
[M+NH4]+	208.04835	142.4
[M+K]+	228.97769	144.5
[M-H]-	189.00725	134.2
[M+Na-2H]-	210.98920	138.5
[M]+	190.01398	136.9
[M]-	190.01508	136.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe