CID 146049084

2411226-76-9

Structural Information

Molecular Formula
C10H11FO4S
SMILES
CC1(COC2=C1C=C(C=C2)OS(=O)(=O)F)C
InChI
InChI=1S/C10H11FO4S/c1-10(2)6-14-9-4-3-7(5-8(9)10)15-16(11,12)13/h3-5H,6H2,1-2H3
InChIKey
UPMFDISFTSTMMD-UHFFFAOYSA-N
Compound name
5-fluorosulfonyloxy-3,3-dimethyl-2H-1-benzofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.03621 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.04349 146.8
[M+Na]+ 269.02543 157.8
[M-H]- 245.02893 151.6
[M+NH4]+ 264.07003 168.7
[M+K]+ 284.99937 156.7
[M+H-H2O]+ 229.03347 142.5
[M+HCOO]- 291.03441 163.0
[M+CH3COO]- 305.05006 187.4
[M+Na-2H]- 267.01088 153.1
[M]+ 246.03566 152.3
[M]- 246.03676 152.3
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.