CID 13035392

2-oxocyclopentanecarboxamide

Structural Information

Molecular Formula

SMILES

C1CC(C(=O)C1)C(=O)N

InChI

InChI=1S/C6H9NO2/c7-6(9)4-2-1-3-5(4)8/h4H,1-3H2,(H2,7,9)

InChIKey

UEPCFCWEIKTKOZ-UHFFFAOYSA-N

Compound name

2-oxocyclopentane-1-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 41
Patents: 127.06333 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]+	128.07061	125.9
[M+Na]+	150.05255	134.1
[M+NH4]+	145.09715	133.6
[M+K]+	166.02649	131.8
[M-H]-	126.05605	126.4
[M+Na-2H]-	148.03800	129.1
[M]+	127.06278	126.7
[M]-	127.06388	126.7

Literature stripe

literature stripe

Patent stripe

patents stripe