CID 4191461

8-methyl-2,3,7,8-tetrahydroimidazo(1,2-a)pyrimidin-5(6h)-one hydriodide

Structural Information

Molecular Formula
C7H11N3O
SMILES
CN1CCC(=O)N2C1=NCC2
InChI
InChI=1S/C7H11N3O/c1-9-4-2-6(11)10-5-3-8-7(9)10/h2-5H2,1H3
InChIKey
QSTYPVLKHSQITM-UHFFFAOYSA-N
Compound name
8-methyl-2,3,6,7-tetrahydroimidazo[1,2-a]pyrimidin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

153.09021 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.09749 132.3
[M+Na]+ 176.07943 141.1
[M-H]- 152.08293 132.5
[M+NH4]+ 171.12403 152.4
[M+K]+ 192.05337 139.3
[M+H-H2O]+ 136.08747 124.8
[M+HCOO]- 198.08841 150.3
[M+CH3COO]- 212.10406 175.4
[M+Na-2H]- 174.06488 137.4
[M]+ 153.08966 129.8
[M]- 153.09076 129.8
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

patents stripe