CID 2763395

77168-31-1

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

205.04068 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.04796 141.6
[M+Na]+ 228.02990 159.3
[M+NH4]+ 223.07450 150.7
[M+K]+ 244.00384 150.7
[M-H]- 204.03340 145.4
[M+Na-2H]- 226.01535 152.7
[M]+ 205.04013 145.7
[M]- 205.04123 145.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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