CID 61950648

3-(4-aminopiperidin-1-yl)pyrrolidine-2,5-dione dihydrochloride

Structural Information

Molecular Formula
C9H15N3O2
SMILES
C1CN(CCC1N)C2CC(=O)NC2=O
InChI
InChI=1S/C9H15N3O2/c10-6-1-3-12(4-2-6)7-5-8(13)11-9(7)14/h6-7H,1-5,10H2,(H,11,13,14)
InChIKey
QAWCPEBARSTQOY-UHFFFAOYSA-N
Compound name
3-(4-aminopiperidin-1-yl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.11642 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.12370 145.0
[M+Na]+ 220.10564 150.5
[M-H]- 196.10914 146.6
[M+NH4]+ 215.15024 162.0
[M+K]+ 236.07958 147.4
[M+H-H2O]+ 180.11368 137.5
[M+HCOO]- 242.11462 161.6
[M+CH3COO]- 256.13027 181.8
[M+Na-2H]- 218.09109 144.9
[M]+ 197.11587 136.0
[M]- 197.11697 136.0
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.