CID 15698252

25032-23-9

Structural Information

Molecular Formula

C₁₂H₁₅NO₂

SMILES

C#CCN1C(=O)CC2(CCCC2)CC1=O

InChI

InChI=1S/C12H15NO2/c1-2-7-13-10(14)8-12(9-11(13)15)5-3-4-6-12/h1H,3-9H2

InChIKey

PSFYTQQKPKMRLG-UHFFFAOYSA-N

Compound name

8-prop-2-ynyl-8-azaspiro[4.5]decane-7,9-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 205.11028 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]+	206.11756	147.5
[M+Na]+	228.09950	157.2
[M+NH4]+	223.14410	153.0
[M+K]+	244.07344	148.1
[M-H]-	204.10300	140.6
[M+Na-2H]-	226.08495	149.2
[M]+	205.10973	146.0
[M]-	205.11083	146.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe