CID 105448

67584-56-9

Structural Information

Molecular Formula
C11H10F11NO4S
SMILES
CN(CCOC(=O)C=C)S(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C11H10F11NO4S/c1-3-6(24)27-5-4-23(2)28(25,26)11(21,22)9(16,17)7(12,13)8(14,15)10(18,19)20/h3H,1,4-5H2,2H3
InChIKey
FZWFDJBZTLTRGH-UHFFFAOYSA-N
Compound name
2-[methyl(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentylsulfonyl)amino]ethyl prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

1
Patents

461.0155 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 462.02278 173.2
[M+Na]+ 484.00472 181.4
[M-H]- 460.00822 180.9
[M+NH4]+ 479.04932 185.7
[M+K]+ 499.97866 184.7
[M+H-H2O]+ 444.01276 166.5
[M+HCOO]- 506.01370 191.1
[M+CH3COO]- 520.02935 230.6
[M+Na-2H]- 481.99017 170.9
[M]+ 461.01495 174.3
[M]- 461.01605 174.3
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

patents stripe