CID 67638

335-97-7

Structural Information

Molecular Formula
C8H6F11NO2S
SMILES
C=CCNS(=O)(=O)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C8H6F11NO2S/c1-2-3-20-23(21,22)8(18,19)6(13,14)4(9,10)5(11,12)7(15,16)17/h2,20H,1,3H2
InChIKey
YJJPIVVOMTXOQC-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4,4,5,5,5-undecafluoro-N-prop-2-enylpentane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

388.99435 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.00163 168.1
[M+Na]+ 411.98357 176.0
[M-H]- 387.98707 155.3
[M+NH4]+ 407.02817 161.5
[M+K]+ 427.95751 172.0
[M+H-H2O]+ 371.99161 155.0
[M+HCOO]- 433.99255 167.4
[M+CH3COO]- 448.00820 216.6
[M+Na-2H]- 409.96902 171.5
[M]+ 388.99380 153.2
[M]- 388.99490 153.2
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.