CID 76849717

5-methylimidazo[1,2-a]pyrimidin-7(8h)-one

Structural Information

Molecular Formula
C7H7N3O
SMILES
CC1=CC(=O)NC2=NC=CN12
InChI
InChI=1S/C7H7N3O/c1-5-4-6(11)9-7-8-2-3-10(5)7/h2-4H,1H3,(H,8,9,11)
InChIKey
GVWALDUEYDNXOO-UHFFFAOYSA-N
Compound name
5-methyl-8H-imidazo[1,2-a]pyrimidin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.05891 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.066186 126.5
[M+Na]+ 172.048128 139.0
[M-H]- 148.051634 126.9
[M+NH4]+ 167.092733 146.5
[M+K]+ 188.022068 135.3
[M+H-H2O]+ 132.056170 119.6
[M+HCOO]- 194.057111 148.8
[M+CH3COO]- 208.072761 141.0
[M+Na-2H]- 170.033576 135.3
[M]+ 149.05836142 127.9
[M]- 149.05945858 127.9
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.