CID 26369835

4-chloro-6-(2-methyl-1h-imidazol-1-yl)pyrimidine

Structural Information

Molecular Formula
C8H7ClN4
SMILES
CC1=NC=CN1C2=CC(=NC=N2)Cl
InChI
InChI=1S/C8H7ClN4/c1-6-10-2-3-13(6)8-4-7(9)11-5-12-8/h2-5H,1H3
InChIKey
KTZYOMJEOTYZAX-UHFFFAOYSA-N
Compound name
4-chloro-6-(2-methylimidazol-1-yl)pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

194.03592 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.04320 137.9
[M+Na]+ 217.02514 153.7
[M+NH4]+ 212.06974 146.1
[M+K]+ 232.99908 148.2
[M-H]- 193.02864 139.9
[M+Na-2H]- 215.01059 147.1
[M]+ 194.03537 141.0
[M]- 194.03647 141.0
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