CID 5357730

Ethenesulfonyl fluoride, 2-phenyl-

Structural Information

Molecular Formula
C8H7FO2S
SMILES
C1=CC=C(C=C1)/C=C/S(=O)(=O)F
InChI
InChI=1S/C8H7FO2S/c9-12(10,11)7-6-8-4-2-1-3-5-8/h1-7H/b7-6+
InChIKey
VDCNEIUADPFQPG-VOTSOKGWSA-N
Compound name
(E)-2-phenylethenesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

186.01508 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.02236 138.1
[M+Na]+ 209.00430 149.5
[M+NH4]+ 204.04890 145.7
[M+K]+ 224.97824 141.5
[M-H]- 185.00780 137.8
[M+Na-2H]- 206.98975 143.8
[M]+ 186.01453 140.0
[M]- 186.01563 140.0
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