CID 155048

N-ethyl-(perfluoropentyl)-n-[2-(2-hydroxyethoxy)ethyl]sulfonamide

Structural Information

Molecular Formula
C11H14F11NO4S
SMILES
CCN(CCOCCO)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C11H14F11NO4S/c1-2-23(3-5-27-6-4-24)28(25,26)11(21,22)9(16,17)7(12,13)8(14,15)10(18,19)20/h24H,2-6H2,1H3
InChIKey
YDFSXFDSBWMWLO-UHFFFAOYSA-N
Compound name
N-ethyl-1,1,2,2,3,3,4,4,5,5,5-undecafluoro-N-[2-(2-hydroxyethoxy)ethyl]pentane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

465.04678 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 466.05406 172.3
[M+Na]+ 488.03600 178.0
[M-H]- 464.03950 176.8
[M+NH4]+ 483.08060 180.6
[M+K]+ 504.00994 181.7
[M+H-H2O]+ 448.04404 172.6
[M+HCOO]- 510.04498 189.5
[M+CH3COO]- 524.06063 230.2
[M+Na-2H]- 486.02145 168.2
[M]+ 465.04623 172.4
[M]- 465.04733 172.4
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

patents stripe