CID 56770224

2171988-69-3

Structural Information

Molecular Formula
C10H16N4O2
SMILES
CN1C(=O)C=C(NC1=O)N2CCCC(C2)N
InChI
InChI=1S/C10H16N4O2/c1-13-9(15)5-8(12-10(13)16)14-4-2-3-7(11)6-14/h5,7H,2-4,6,11H2,1H3,(H,12,16)
InChIKey
XTXAQEOHHNTCFA-UHFFFAOYSA-N
Compound name
6-(3-aminopiperidin-1-yl)-3-methyl-1H-pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

224.12732 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.13460 150.1
[M+Na]+ 247.11654 161.8
[M+NH4]+ 242.16114 155.9
[M+K]+ 263.09048 157.0
[M-H]- 223.12004 151.4
[M+Na-2H]- 245.10199 155.1
[M]+ 224.12677 151.7
[M]- 224.12787 151.7
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

patents stripe