CID 136958292

2361645-13-6

Structural Information

Molecular Formula
C9H14N4O
SMILES
C1CC(CN(C1)C2=CC(=O)NC=N2)N
InChI
InChI=1S/C9H14N4O/c10-7-2-1-3-13(5-7)8-4-9(14)12-6-11-8/h4,6-7H,1-3,5,10H2,(H,11,12,14)
InChIKey
TZMSSAKOCCFPGJ-UHFFFAOYSA-N
Compound name
4-(3-aminopiperidin-1-yl)-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.11676 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.12404 142.7
[M+Na]+ 217.10598 154.4
[M+NH4]+ 212.15058 149.6
[M+K]+ 233.07992 148.9
[M-H]- 193.10948 144.7
[M+Na-2H]- 215.09143 149.2
[M]+ 194.11621 144.6
[M]- 194.11731 144.6
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.