CID 12799

1,3-diazaspiro[4.5]decane-2,4-dione

Structural Information

Molecular Formula
C8H12N2O2
SMILES
C1CCC2(CC1)C(=O)NC(=O)N2
InChI
InChI=1S/C8H12N2O2/c11-6-8(10-7(12)9-6)4-2-1-3-5-8/h1-5H2,(H2,9,10,11,12)
InChIKey
NERNEXMEYQFFHU-UHFFFAOYSA-N
Compound name
1,3-diazaspiro[4.5]decane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

10
References

481
Patents

168.08987 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.09715 138.6
[M+Na]+ 191.07909 147.2
[M+NH4]+ 186.12369 147.1
[M+K]+ 207.05303 142.4
[M-H]- 167.08259 138.2
[M+Na-2H]- 189.06454 142.6
[M]+ 168.08932 139.3
[M]- 168.09042 139.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe