CID 75480961

2-(2,2-difluoroethoxy)ethane-1-sulfonamide

Structural Information

Molecular Formula
C4H9F2NO3S
SMILES
C(CS(=O)(=O)N)OCC(F)F
InChI
InChI=1S/C4H9F2NO3S/c5-4(6)3-10-1-2-11(7,8)9/h4H,1-3H2,(H2,7,8,9)
InChIKey
HSYBJJYIEHCUBU-UHFFFAOYSA-N
Compound name
2-(2,2-difluoroethoxy)ethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.02711 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.03439 132.8
[M+Na]+ 212.01633 140.2
[M-H]- 188.01983 130.0
[M+NH4]+ 207.06093 152.0
[M+K]+ 227.99027 138.9
[M+H-H2O]+ 172.02437 125.9
[M+HCOO]- 234.02531 148.4
[M+CH3COO]- 248.04096 180.0
[M+Na-2H]- 210.00178 135.1
[M]+ 189.02656 132.8
[M]- 189.02766 132.8
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.