CID 168688

1,1-dibromotetrafluoroethane

Structural Information

Molecular Formula
C2Br2F4
SMILES
C(C(F)(Br)Br)(F)(F)F
InChI
InChI=1S/C2Br2F4/c3-1(4,5)2(6,7)8
InChIKey
JLGADZLAECENGR-UHFFFAOYSA-N
Compound name
1,1-dibromo-1,2,2,2-tetrafluoroethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1688
Patents

257.8303 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.83758 140.2
[M+Na]+ 280.81952 152.7
[M-H]- 256.82302 141.0
[M+NH4]+ 275.86412 160.5
[M+K]+ 296.79346 136.9
[M+H-H2O]+ 240.82756 146.7
[M+HCOO]- 302.82850 151.5
[M+CH3COO]- 316.84415 196.5
[M+Na-2H]- 278.80497 147.4
[M]+ 257.82975 168.3
[M]- 257.83085 168.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe