CID 105437

N-allyltridecafluorohexanesulphonamide

Structural Information

Molecular Formula
C9H6F13NO2S
SMILES
C=CCNS(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C9H6F13NO2S/c1-2-3-23-26(24,25)9(21,22)7(16,17)5(12,13)4(10,11)6(14,15)8(18,19)20/h2,23H,1,3H2
InChIKey
OEYYQKXFSDVKJI-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-N-prop-2-enylhexane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

438.99118 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.99846 182.8
[M+Na]+ 461.98040 182.4
[M+NH4]+ 457.02500 181.7
[M+K]+ 477.95434 181.1
[M-H]- 437.98390 178.2
[M+Na-2H]- 459.96585 180.7
[M]+ 438.99063 181.3
[M]- 438.99173 181.3
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

No patent data available for this compound.