CID 118989196

2-chloro-6-(1h-pyrazol-4-yl)pyridine

Structural Information

Molecular Formula
C8H6ClN3
SMILES
C1=CC(=NC(=C1)Cl)C2=CNN=C2
InChI
InChI=1S/C8H6ClN3/c9-8-3-1-2-7(12-8)6-4-10-11-5-6/h1-5H,(H,10,11)
InChIKey
FGGUABZAESHRBJ-UHFFFAOYSA-N
Compound name
2-chloro-6-(1H-pyrazol-4-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.02502 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.03230 134.2
[M+Na]+ 202.01424 149.3
[M+NH4]+ 197.05884 142.9
[M+K]+ 217.98818 143.7
[M-H]- 178.01774 136.5
[M+Na-2H]- 199.99969 143.5
[M]+ 179.02447 137.3
[M]- 179.02557 137.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.