CID 139598187

Dhpflsa, n=2

Structural Information

Molecular Formula
C6H2F10O3S
SMILES
C(/C(=C(/C(F)(F)F)\F)/F)(C(C(F)(F)S(=O)(=O)O)(F)F)F
InChI
InChI=1S/C6H2F10O3S/c7-1(3(9)5(12,13)14)2(8)4(10,11)6(15,16)20(17,18)19/h2H,(H,17,18,19)/b3-1+
InChIKey
ZHIXQINEHBMCSU-HNQUOIGGSA-N
Compound name
(E)-1,1,2,2,3,4,5,6,6,6-decafluorohex-4-ene-1-sulfonic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

343.95648 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.96376 152.0
[M+Na]+ 366.94570 159.9
[M-H]- 342.94920 138.9
[M+NH4]+ 361.99030 163.8
[M+K]+ 382.91964 156.7
[M+H-H2O]+ 326.95374 140.2
[M+HCOO]- 388.95468 150.9
[M+CH3COO]- 402.97033 203.3
[M+Na-2H]- 364.93115 151.0
[M]+ 343.95593 138.0
[M]- 343.95703 138.0
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.