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]+ 140.08183 128.4
[M+Na]+ 162.06377 136.2
[M-H]- 138.06727 127.0
[M+NH4]+ 157.10837 147.9
[M+K]+ 178.03771 133.8
[M+H-H2O]+ 122.07181 121.0
[M+HCOO]- 184.07275 145.2
[M+CH3COO]- 198.08840 140.5
[M+Na-2H]- 160.04922 134.2
[M]+ 139.07400 123.2
[M]- 139.07510 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.