CID 67356903

2-(chloromethyl)-4-fluoropyridine hydrochloride

Structural Information

Molecular Formula
C6H5ClFN
SMILES
C1=CN=C(C=C1F)CCl
InChI
InChI=1S/C6H5ClFN/c7-4-6-3-5(8)1-2-9-6/h1-3H,4H2
InChIKey
FFEPTXWHGIRHKJ-UHFFFAOYSA-N
Compound name
2-(chloromethyl)-4-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

145.00946 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.01674 122.5
[M+Na]+ 167.99868 137.0
[M+NH4]+ 163.04328 131.8
[M+K]+ 183.97262 129.4
[M-H]- 144.00218 123.7
[M+Na-2H]- 165.98413 130.9
[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.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe