CID 84787

15089-99-3

Structural Information

Molecular Formula
C13H23N3O2
SMILES
CCN(CC)CN1C(=O)C2(CCCCC2)NC1=O
InChI
InChI=1S/C13H23N3O2/c1-3-15(4-2)10-16-11(17)13(14-12(16)18)8-6-5-7-9-13/h3-10H2,1-2H3,(H,14,18)
InChIKey
MUALGSHTPBHVEG-UHFFFAOYSA-N
Compound name
3-(diethylaminomethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.17903 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.18631 160.4
[M+Na]+ 276.16825 165.0
[M-H]- 252.17175 162.3
[M+NH4]+ 271.21285 178.3
[M+K]+ 292.14219 162.7
[M+H-H2O]+ 236.17629 152.8
[M+HCOO]- 298.17723 176.8
[M+CH3COO]- 312.19288 196.4
[M+Na-2H]- 274.15370 161.2
[M]+ 253.17848 155.7
[M]- 253.17958 155.7
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

No patent data available for this compound.