CID 14897549

133042-64-5

Structural Information

Molecular Formula
C10H7FO3S
SMILES
C1=CC=C2C(=C1)C=CC=C2OS(=O)(=O)F
InChI
InChI=1S/C10H7FO3S/c11-15(12,13)14-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
InChIKey
GEZWNEDYJCOWLU-UHFFFAOYSA-N
Compound name
1-fluorosulfonyloxynaphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

226.01 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.01728 141.8
[M+Na]+ 248.99922 152.1
[M-H]- 225.00272 145.7
[M+NH4]+ 244.04382 161.6
[M+K]+ 264.97316 148.7
[M+H-H2O]+ 209.00726 135.4
[M+HCOO]- 271.00820 159.2
[M+CH3COO]- 285.02385 184.3
[M+Na-2H]- 246.98467 149.3
[M]+ 226.00945 144.9
[M]- 226.01055 144.9
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