CID 56404

92367-74-3

Structural Information

Molecular Formula
C11H13NO2
SMILES
C#CCN1C(=O)CC2(C1=O)CCCC2
InChI
InChI=1S/C11H13NO2/c1-2-7-12-9(13)8-11(10(12)14)5-3-4-6-11/h1H,3-8H2
InChIKey
FAISTMNDMCILQH-UHFFFAOYSA-N
Compound name
2-prop-2-ynyl-2-azaspiro[4.4]nonane-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.09464 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.101916 142.7
[M+Na]+ 214.083858 153.7
[M-H]- 190.087364 145.4
[M+NH4]+ 209.128463 164.2
[M+K]+ 230.057798 147.5
[M+H-H2O]+ 174.091900 131.1
[M+HCOO]- 236.092841 157.9
[M+CH3COO]- 250.108491 188.5
[M+Na-2H]- 212.069306 143.5
[M]+ 191.09409142 134.8
[M]- 191.09518858 134.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.