CID 23469702

3-chloro-2,4-difluoropyridine

Structural Information

Molecular Formula
C5H2ClF2N
SMILES
C1=CN=C(C(=C1F)Cl)F
InChI
InChI=1S/C5H2ClF2N/c6-4-3(7)1-2-9-5(4)8/h1-2H
InChIKey
ALWGESCEYWGLQF-UHFFFAOYSA-N
Compound name
3-chloro-2,4-difluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

148.98439 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.99167 118.5
[M+Na]+ 171.97361 130.4
[M-H]- 147.97711 118.9
[M+NH4]+ 167.01821 139.8
[M+K]+ 187.94755 126.7
[M+H-H2O]+ 131.98165 112.0
[M+HCOO]- 193.98259 136.4
[M+CH3COO]- 207.99824 173.6
[M+Na-2H]- 169.95906 126.2
[M]+ 148.98384 117.9
[M]- 148.98494 117.9
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