CID 165944166

5-chloro-2-(1,2,3,6-tetrahydropyridin-4-yl)pyrimidine hydrochloride

Structural Information

Molecular Formula
C9H10ClN3
SMILES
C1CNCC=C1C2=NC=C(C=N2)Cl
InChI
InChI=1S/C9H10ClN3/c10-8-5-12-9(13-6-8)7-1-3-11-4-2-7/h1,5-6,11H,2-4H2
InChIKey
OMMTUJBJMIXVJJ-UHFFFAOYSA-N
Compound name
5-chloro-2-(1,2,3,6-tetrahydropyridin-4-yl)pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.05632 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.06360 140.5
[M+Na]+ 218.04554 155.6
[M+NH4]+ 213.09014 149.2
[M+K]+ 234.01948 147.7
[M-H]- 194.04904 143.3
[M+Na-2H]- 216.03099 149.6
[M]+ 195.05577 143.7
[M]- 195.05687 143.7
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.