CID 693330

2-(chloromethyl)-5,7-dimethylimidazo[1,2-a]pyrimidine

Structural Information

Molecular Formula
C9H10ClN3
SMILES
CC1=CC(=NC2=NC(=CN12)CCl)C
InChI
InChI=1S/C9H10ClN3/c1-6-3-7(2)13-5-8(4-10)12-9(13)11-6/h3,5H,4H2,1-2H3
InChIKey
CMDAULOGOZCZQT-UHFFFAOYSA-N
Compound name
2-(chloromethyl)-5,7-dimethylimidazo[1,2-a]pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

195.05632 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.06360 138.2
[M+Na]+ 218.04554 154.3
[M+NH4]+ 213.09014 147.2
[M+K]+ 234.01948 148.2
[M-H]- 194.04904 139.6
[M+Na-2H]- 216.03099 145.4
[M]+ 195.05577 141.3
[M]- 195.05687 141.3
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