CID 86811807

3-(3-aminopiperidin-1-yl)-1,2-dihydropyrazin-2-one dihydrochloride

Structural Information

Molecular Formula
C9H14N4O
SMILES
C1CC(CN(C1)C2=NC=CNC2=O)N
InChI
InChI=1S/C9H14N4O/c10-7-2-1-5-13(6-7)8-9(14)12-4-3-11-8/h3-4,7H,1-2,5-6,10H2,(H,12,14)
InChIKey
UYLGXBDOJZYNTH-UHFFFAOYSA-N
Compound name
3-(3-aminopiperidin-1-yl)-1H-pyrazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.11676 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.124036 143.9
[M+Na]+ 217.105978 150.5
[M-H]- 193.109484 144.3
[M+NH4]+ 212.150583 157.7
[M+K]+ 233.079918 146.3
[M+H-H2O]+ 177.114020 134.9
[M+HCOO]- 239.114961 160.8
[M+CH3COO]- 253.130611 154.4
[M+Na-2H]- 215.091426 149.0
[M]+ 194.11621142 136.4
[M]- 194.11730858 136.4
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.