CID 25323207

3-(3-aminopropyl)-1,3-diazaspiro[4.4]nonane-2,4-dione

Structural Information

Molecular Formula
C10H17N3O2
SMILES
C1CCC2(C1)C(=O)N(C(=O)N2)CCCN
InChI
InChI=1S/C10H17N3O2/c11-6-3-7-13-8(14)10(12-9(13)15)4-1-2-5-10/h1-7,11H2,(H,12,15)
InChIKey
MMXVHUNQNUFIDW-UHFFFAOYSA-N
Compound name
3-(3-aminopropyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.13208 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.139356 148.0
[M+Na]+ 234.121298 154.5
[M-H]- 210.124804 149.0
[M+NH4]+ 229.165903 168.5
[M+K]+ 250.095238 151.3
[M+H-H2O]+ 194.129340 141.5
[M+HCOO]- 256.130281 166.4
[M+CH3COO]- 270.145931 183.4
[M+Na-2H]- 232.106746 148.6
[M]+ 211.13153142 142.2
[M]- 211.13262858 142.2
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.