CID 26986016

2,5-dichloro-4-(trifluoromethyl)pyridine

Structural Information

Molecular Formula
C6H2Cl2F3N
SMILES
C1=C(C(=CN=C1Cl)Cl)C(F)(F)F
InChI
InChI=1S/C6H2Cl2F3N/c7-4-2-12-5(8)1-3(4)6(9,10)11/h1-2H
InChIKey
GFTRYJQAASFSIB-UHFFFAOYSA-N
Compound name
2,5-dichloro-4-(trifluoromethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

153
Patents

214.95164 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.95892 136.1
[M+Na]+ 237.94086 147.8
[M+NH4]+ 232.98546 142.8
[M+K]+ 253.91480 141.8
[M-H]- 213.94436 133.3
[M+Na-2H]- 235.92631 141.8
[M]+ 214.95109 137.3
[M]- 214.95219 137.3
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