CID 58615081

8-amino-2-azaspiro[4.5]decan-3-one

Structural Information

Molecular Formula

C₉H₁₆N₂O

SMILES

C1CC2(CCC1N)CC(=O)NC2

InChI

InChI=1S/C9H16N2O/c10-7-1-3-9(4-2-7)5-8(12)11-6-9/h7H,1-6,10H2,(H,11,12)

InChIKey

BVLKRYJHZIYNIK-UHFFFAOYSA-N

Compound name

8-amino-2-azaspiro[4.5]decan-3-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 168.12627 Da
Monoisotopic Mass: -0.3
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]+	169.13355	138.8
[M+Na]+	191.11549	146.7
[M+NH4]+	186.16009	148.4
[M+K]+	207.08943	141.4
[M-H]-	167.11899	140.5
[M+Na-2H]-	189.10094	143.4
[M]+	168.12572	140.0
[M]-	168.12682	140.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe