CID 165819563

2-bromo-5-(2-bromo-1,1,2,2-tetrafluoroethoxy)pyridine

Structural Information

Molecular Formula
C7H3Br2F4NO
SMILES
C1=CC(=NC=C1OC(C(F)(F)Br)(F)F)Br
InChI
InChI=1S/C7H3Br2F4NO/c8-5-2-1-4(3-14-5)15-7(12,13)6(9,10)11/h1-3H
InChIKey
FWPHJTZDQAMCGB-UHFFFAOYSA-N
Compound name
2-bromo-5-(2-bromo-1,1,2,2-tetrafluoroethoxy)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.85175 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.85903 157.3
[M+Na]+ 373.84097 169.1
[M-H]- 349.84447 159.3
[M+NH4]+ 368.88557 173.7
[M+K]+ 389.81491 153.2
[M+H-H2O]+ 333.84901 162.9
[M+HCOO]- 395.84995 167.7
[M+CH3COO]- 409.86560 208.7
[M+Na-2H]- 371.82642 164.1
[M]+ 350.85120 187.4
[M]- 350.85230 187.4
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.