CID 119006389

2,6-dibromo-4-(difluoromethyl)pyridine

Structural Information

Molecular Formula
C6H3Br2F2N
SMILES
C1=C(C=C(N=C1Br)Br)C(F)F
InChI
InChI=1S/C6H3Br2F2N/c7-4-1-3(6(9)10)2-5(8)11-4/h1-2,6H
InChIKey
SUXPXTUYNMILLJ-UHFFFAOYSA-N
Compound name
2,6-dibromo-4-(difluoromethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

284.86002 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.86730 136.0
[M+Na]+ 307.84924 148.2
[M-H]- 283.85274 140.2
[M+NH4]+ 302.89384 154.9
[M+K]+ 323.82318 132.7
[M+H-H2O]+ 267.85728 143.0
[M+HCOO]- 329.85822 150.2
[M+CH3COO]- 343.87387 201.6
[M+Na-2H]- 305.83469 142.8
[M]+ 284.85947 167.8
[M]- 284.86057 167.8
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