CID 19936979

705-33-9

Structural Information

Molecular Formula
C8H7FO2S
SMILES
C=CC1=CC=C(C=C1)S(=O)(=O)F
InChI
InChI=1S/C8H7FO2S/c1-2-7-3-5-8(6-4-7)12(9,10)11/h2-6H,1H2
InChIKey
AANYPNZHPGEIOT-UHFFFAOYSA-N
Compound name
4-ethenylbenzenesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

186.01508 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.02236 138.1
[M+Na]+ 209.00430 149.8
[M+NH4]+ 204.04890 145.8
[M+K]+ 224.97824 142.1
[M-H]- 185.00780 137.8
[M+Na-2H]- 206.98975 143.6
[M]+ 186.01453 140.1
[M]- 186.01563 140.1
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