CID 55265572

2-oxa-8-azaspiro[4.5]decan-1-one hydrochloride

Structural Information

Molecular Formula

C₈H₁₃NO₂

SMILES

C1CNCCC12CCOC2=O

InChI

InChI=1S/C8H13NO2/c10-7-8(3-6-11-7)1-4-9-5-2-8/h9H,1-6H2

InChIKey

HZLUMDLSMBEFMQ-UHFFFAOYSA-N

Compound name

2-oxa-8-azaspiro[4.5]decan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 52
Patents: 155.09464 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]+	156.10192	134.6
[M+Na]+	178.08386	143.9
[M+NH4]+	173.12846	144.4
[M+K]+	194.05780	138.8
[M-H]-	154.08736	137.1
[M+Na-2H]-	176.06931	139.5
[M]+	155.09409	136.4
[M]-	155.09519	136.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe