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

12
Patents

182.06914 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.07642 138.7
[M+Na]+ 205.05836 146.0
[M-H]- 181.06186 138.8
[M+NH4]+ 200.10296 158.4
[M+K]+ 221.03230 142.6
[M+H-H2O]+ 165.06640 132.7
[M+HCOO]- 227.06734 154.1
[M+CH3COO]- 241.08299 171.9
[M+Na-2H]- 203.04381 141.7
[M]+ 182.06859 130.7
[M]- 182.06969 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