CID 67814

375-72-4

Structural Information

Molecular Formula
C4F10O2S
SMILES
C(C(C(F)(F)S(=O)(=O)F)(F)F)(C(F)(F)F)(F)F
InChI
InChI=1S/C4F10O2S/c5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16
InChIKey
LUYQYZLEHLTPBH-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

109
References

8017
Patents

301.94592 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.95320 145.5
[M+Na]+ 324.93514 155.5
[M-H]- 300.93864 134.4
[M+NH4]+ 319.97974 159.9
[M+K]+ 340.90908 152.7
[M+H-H2O]+ 284.94318 133.9
[M+HCOO]- 346.94412 147.3
[M+CH3COO]- 360.95977 198.3
[M+Na-2H]- 322.92059 149.2
[M]+ 301.94537 133.0
[M]- 301.94647 133.0
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.