CID 165651964

4-(1,1,2,2-tetrafluoroethoxy)benzene-1-sulfonamide

Structural Information

Molecular Formula
C8H7F4NO3S
SMILES
C1=CC(=CC=C1OC(C(F)F)(F)F)S(=O)(=O)N
InChI
InChI=1S/C8H7F4NO3S/c9-7(10)8(11,12)16-5-1-3-6(4-2-5)17(13,14)15/h1-4,7H,(H2,13,14,15)
InChIKey
BWCJQWRUHSNDDV-UHFFFAOYSA-N
Compound name
4-(1,1,2,2-tetrafluoroethoxy)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.00827 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.01555 148.9
[M+Na]+ 295.99749 157.4
[M-H]- 272.00099 147.0
[M+NH4]+ 291.04209 164.6
[M+K]+ 311.97143 154.1
[M+H-H2O]+ 256.00553 139.6
[M+HCOO]- 318.00647 161.3
[M+CH3COO]- 332.02212 194.6
[M+Na-2H]- 293.98294 151.4
[M]+ 273.00772 145.5
[M]- 273.00882 145.5
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.