CID 146155767

3-chloro-2,4-difluoro-5-methylpyridine

Structural Information

Molecular Formula
C6H4ClF2N
SMILES
CC1=CN=C(C(=C1F)Cl)F
InChI
InChI=1S/C6H4ClF2N/c1-3-2-10-6(9)4(7)5(3)8/h2H,1H3
InChIKey
LDQCWZYLJKRUHM-UHFFFAOYSA-N
Compound name
3-chloro-2,4-difluoro-5-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.00003 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.00731 122.9
[M+Na]+ 185.98925 135.2
[M-H]- 161.99275 123.4
[M+NH4]+ 181.03385 143.9
[M+K]+ 201.96319 131.3
[M+H-H2O]+ 145.99729 116.4
[M+HCOO]- 207.99823 140.4
[M+CH3COO]- 222.01388 177.7
[M+Na-2H]- 183.97470 129.2
[M]+ 162.99948 123.0
[M]- 163.00058 123.0
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.