CID 824585

4-chloro-2-methyl-6-(pyridin-2-yl)pyrimidine

Structural Information

Molecular Formula
C10H8ClN3
SMILES
CC1=NC(=CC(=N1)Cl)C2=CC=CC=N2
InChI
InChI=1S/C10H8ClN3/c1-7-13-9(6-10(11)14-7)8-4-2-3-5-12-8/h2-6H,1H3
InChIKey
ZWHZRLMJZKIKGZ-UHFFFAOYSA-N
Compound name
4-chloro-2-methyl-6-pyridin-2-ylpyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

205.04068 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.047956 141.0
[M+Na]+ 228.029898 152.0
[M-H]- 204.033404 143.8
[M+NH4]+ 223.074503 156.9
[M+K]+ 244.003838 146.7
[M+H-H2O]+ 188.037940 132.3
[M+HCOO]- 250.038881 157.8
[M+CH3COO]- 264.054531 154.0
[M+Na-2H]- 226.015346 149.4
[M]+ 205.04013142 142.8
[M]- 205.04122858 142.8
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