CID 115534

Sodium 1-isopropyl-7,9-diazaspiro(4.5)decane-6,8,10-trione

Structural Information

Molecular Formula
C11H16N2O3
SMILES
CC(C)C1CCCC12C(=O)NC(=O)NC2=O
InChI
InChI=1S/C11H16N2O3/c1-6(2)7-4-3-5-11(7)8(14)12-10(16)13-9(11)15/h6-7H,3-5H2,1-2H3,(H2,12,13,14,15,16)
InChIKey
UVBKWQDSFVYQLH-UHFFFAOYSA-N
Compound name
4-propan-2-yl-7,9-diazaspiro[4.5]decane-6,8,10-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.11609 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.123366 151.2
[M+Na]+ 247.105308 157.8
[M-H]- 223.108814 151.2
[M+NH4]+ 242.149913 169.4
[M+K]+ 263.079248 154.2
[M+H-H2O]+ 207.113350 145.4
[M+HCOO]- 269.114291 164.5
[M+CH3COO]- 283.129941 183.1
[M+Na-2H]- 245.090756 151.0
[M]+ 224.11554142 144.0
[M]- 224.11663858 144.0
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.