CID 20112916

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

Structural Information

Molecular Formula
C11H19N3O2
SMILES
C1CCC2(C1)C(=O)N(C(=O)N2)CCCCN
InChI
InChI=1S/C11H19N3O2/c12-7-3-4-8-14-9(15)11(13-10(14)16)5-1-2-6-11/h1-8,12H2,(H,13,16)
InChIKey
GFVNEEAXZJYMBR-UHFFFAOYSA-N
Compound name
3-(4-aminobutyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.14772 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.154996 152.3
[M+Na]+ 248.136938 158.3
[M-H]- 224.140444 153.1
[M+NH4]+ 243.181543 172.3
[M+K]+ 264.110878 155.0
[M+H-H2O]+ 208.144980 145.6
[M+HCOO]- 270.145921 170.4
[M+CH3COO]- 284.161571 186.4
[M+Na-2H]- 246.122386 152.4
[M]+ 225.14717142 146.8
[M]- 225.14826858 146.8
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.