CID 19867376

6-chloro-3-fluoro-2-methylpyridine

Structural Information

Molecular Formula
C6H5ClFN
SMILES
CC1=C(C=CC(=N1)Cl)F
InChI
InChI=1S/C6H5ClFN/c1-4-5(8)2-3-6(7)9-4/h2-3H,1H3
InChIKey
ICSRNKKGNHKSJH-UHFFFAOYSA-N
Compound name
6-chloro-3-fluoro-2-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

187
Patents

145.00946 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.01674 122.4
[M+Na]+ 167.99868 137.2
[M+NH4]+ 163.04328 131.7
[M+K]+ 183.97262 129.8
[M-H]- 144.00218 123.6
[M+Na-2H]- 165.98413 130.5
[M]+ 145.00891 125.2
[M]- 145.01001 125.2
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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