CID 115018871

(2-fluorophenyl)methanesulfonyl fluoride

Structural Information

Molecular Formula
C7H6F2O2S
SMILES
C1=CC=C(C(=C1)CS(=O)(=O)F)F
InChI
InChI=1S/C7H6F2O2S/c8-7-4-2-1-3-6(7)5-12(9,10)11/h1-4H,5H2
InChIKey
UJPGYJAKSFVRGJ-UHFFFAOYSA-N
Compound name
(2-fluorophenyl)methanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.00566 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.01294 131.6
[M+Na]+ 214.99488 141.8
[M-H]- 190.99838 133.5
[M+NH4]+ 210.03948 151.9
[M+K]+ 230.96882 138.7
[M+H-H2O]+ 175.00292 124.8
[M+HCOO]- 237.00386 148.7
[M+CH3COO]- 251.01951 178.4
[M+Na-2H]- 212.98033 136.3
[M]+ 192.00511 132.1
[M]- 192.00621 132.1
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

No patent data available for this compound.