CID 66728930

1,3-diazaspiro[4.5]decane-2,4,8-trione

Structural Information

Molecular Formula
C8H10N2O3
SMILES
C1CC2(CCC1=O)C(=O)NC(=O)N2
InChI
InChI=1S/C8H10N2O3/c11-5-1-3-8(4-2-5)6(12)9-7(13)10-8/h1-4H2,(H2,9,10,12,13)
InChIKey
IVSBWJVHDCWNQR-UHFFFAOYSA-N
Compound name
1,3-diazaspiro[4.5]decane-2,4,8-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

182.06914 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.076416 138.7
[M+Na]+ 205.058358 146.0
[M-H]- 181.061864 138.8
[M+NH4]+ 200.102963 158.4
[M+K]+ 221.032298 142.6
[M+H-H2O]+ 165.066400 132.7
[M+HCOO]- 227.067341 154.1
[M+CH3COO]- 241.082991 171.9
[M+Na-2H]- 203.043806 141.7
[M]+ 182.06859142 130.7
[M]- 182.06968858 130.7
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

patents stripe