CID 167264

2h,3h,5h,6h,7h,8h-imidazo[1,2-a]pyrimidin-5-one hydroiodide

Structural Information

Molecular Formula
C6H9N3O
SMILES
C1CN=C2NCCN2C1=O
InChI
InChI=1S/C6H9N3O/c10-5-1-2-7-6-8-3-4-9(5)6/h1-4H2,(H,7,8)
InChIKey
KXOXEIRPXQUVET-UHFFFAOYSA-N
Compound name
2,3,6,7-tetrahydro-1H-imidazo[1,2-a]pyrimidin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.07455 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.081826 128.4
[M+Na]+ 162.063768 136.2
[M-H]- 138.067274 127.0
[M+NH4]+ 157.108373 147.9
[M+K]+ 178.037708 133.8
[M+H-H2O]+ 122.071810 121.0
[M+HCOO]- 184.072751 145.2
[M+CH3COO]- 198.088401 140.5
[M+Na-2H]- 160.049216 134.2
[M]+ 139.07400142 123.2
[M]- 139.07509858 123.2
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.