CID 132342291

5-bromofuran-2-sulfonyl fluoride

Structural Information

Molecular Formula
C4H2BrFO3S
SMILES
C1=C(OC(=C1)Br)S(=O)(=O)F
InChI
InChI=1S/C4H2BrFO3S/c5-3-1-2-4(9-3)10(6,7)8/h1-2H
InChIKey
BLOOWHYEGMAMPS-UHFFFAOYSA-N
Compound name
5-bromofuran-2-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.8892 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.89648 128.7
[M+Na]+ 250.87842 143.8
[M-H]- 226.88192 135.8
[M+NH4]+ 245.92302 151.9
[M+K]+ 266.85236 134.4
[M+H-H2O]+ 210.88646 129.9
[M+HCOO]- 272.88740 146.1
[M+CH3COO]- 286.90305 179.5
[M+Na-2H]- 248.86387 136.0
[M]+ 227.88865 150.5
[M]- 227.88975 150.5
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.