CID 2782267

1-(2-bromo-1,1,2,2-tetrafluoroethoxy)-1,2,2-trifluoroethene

Structural Information

Molecular Formula
C4BrF7O
SMILES
C(=C(F)F)(OC(C(F)(F)Br)(F)F)F
InChI
InChI=1S/C4BrF7O/c5-3(9,10)4(11,12)13-2(8)1(6)7
InChIKey
ZPYGRBTUNITHKJ-UHFFFAOYSA-N
Compound name
1-bromo-1,1,2,2-tetrafluoro-2-(1,2,2-trifluoroethenoxy)ethane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

607
Patents

275.90207 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.90935 149.4
[M+Na]+ 298.89129 161.7
[M-H]- 274.89479 144.4
[M+NH4]+ 293.93589 168.5
[M+K]+ 314.86523 150.6
[M+H-H2O]+ 258.89933 145.2
[M+HCOO]- 320.90027 159.7
[M+CH3COO]- 334.91592 193.8
[M+Na-2H]- 296.87674 152.5
[M]+ 275.90152 157.3
[M]- 275.90262 157.3
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