CID 11730

Bromotrifluoroethylene

Structural Information

Molecular Formula
C2BrF3
SMILES
C(=C(F)Br)(F)F
InChI
InChI=1S/C2BrF3/c3-1(4)2(5)6
InChIKey
AYCANDRGVPTASA-UHFFFAOYSA-N
Compound name
1-bromo-1,2,2-trifluoroethene
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

3
References

4997
Patents

159.91354 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.92082 121.6
[M+Na]+ 182.90276 133.8
[M-H]- 158.90626 121.5
[M+NH4]+ 177.94736 145.6
[M+K]+ 198.87670 123.9
[M+H-H2O]+ 142.91080 120.7
[M+HCOO]- 204.91174 139.4
[M+CH3COO]- 218.92739 174.9
[M+Na-2H]- 180.88821 127.5
[M]+ 159.91299 134.2
[M]- 159.91409 134.2
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