CID 223267

2,8-diazaspiro[5.5]undecane-1,3,7,9-tetrone

Structural Information

Molecular Formula
C9H10N2O4
SMILES
C1CC2(CCC(=O)NC2=O)C(=O)NC1=O
InChI
InChI=1S/C9H10N2O4/c12-5-1-3-9(7(14)10-5)4-2-6(13)11-8(9)15/h1-4H2,(H,10,12,14)(H,11,13,15)
InChIKey
VLXWUMRXYIGSMF-UHFFFAOYSA-N
Compound name
2,8-diazaspiro[5.5]undecane-1,3,7,9-tetrone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

210.06406 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.07134 144.3
[M+Na]+ 233.05328 151.4
[M-H]- 209.05678 144.2
[M+NH4]+ 228.09788 161.1
[M+K]+ 249.02722 147.9
[M+H-H2O]+ 193.06132 137.9
[M+HCOO]- 255.06226 157.5
[M+CH3COO]- 269.07791 178.3
[M+Na-2H]- 231.03873 147.9
[M]+ 210.06351 135.8
[M]- 210.06461 135.8
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.