CID 132343720

1-bromo-1-trifluoromethanesulfonylethene

Structural Information

Molecular Formula
C3H2BrF3O2S
SMILES
C=C(S(=O)(=O)C(F)(F)F)Br
InChI
InChI=1S/C3H2BrF3O2S/c1-2(4)10(8,9)3(5,6)7/h1H2
InChIKey
LHSATIDRWFHKJE-UHFFFAOYSA-N
Compound name
1-bromo-1-(trifluoromethylsulfonyl)ethene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.8911 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.89838 129.7
[M+Na]+ 260.88032 143.1
[M-H]- 236.88382 130.0
[M+NH4]+ 255.92492 151.4
[M+K]+ 276.85426 131.5
[M+H-H2O]+ 220.88836 129.0
[M+HCOO]- 282.88930 141.1
[M+CH3COO]- 296.90495 182.9
[M+Na-2H]- 258.86577 135.0
[M]+ 237.89055 145.7
[M]- 237.89165 145.7
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.