CID 2732366

81305-70-6

Structural Information

Molecular Formula

C₁₁H₁₀ClNO₂

SMILES

C1CC(=O)N(C(=O)C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C11H10ClNO2/c12-8-4-6-9(7-5-8)13-10(14)2-1-3-11(13)15/h4-7H,1-3H2

InChIKey

HXXVDRRWNNHFTI-UHFFFAOYSA-N

Compound name

1-(4-chlorophenyl)piperidine-2,6-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 223.04001 Da
Monoisotopic Mass: 1.3
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]+	224.04729	145.0
[M+Na]+	246.02923	153.9
[M-H]-	222.03273	150.2
[M+NH4]+	241.07383	162.8
[M+K]+	262.00317	149.4
[M+H-H2O]+	206.03727	138.3
[M+HCOO]-	268.03821	161.0
[M+CH3COO]-	282.05386	186.3
[M+Na-2H]-	244.01468	149.1
[M]+	223.03946	143.9
[M]-	223.04056	143.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe