CID 11781540

1,1,2,2-tetrafluoro-2-(1,2,2-trifluorovinyloxy)ethanesulfonic acid

Structural Information

Molecular Formula
C4HF7O4S
SMILES
C(=C(F)F)(OC(C(F)(F)S(=O)(=O)O)(F)F)F
InChI
InChI=1S/C4HF7O4S/c5-1(6)2(7)15-3(8,9)4(10,11)16(12,13)14/h(H,12,13,14)
InChIKey
BSJWZISVMPPTAG-UHFFFAOYSA-N
Compound name
1,1,2,2-tetrafluoro-2-(1,2,2-trifluoroethenoxy)ethanesulfonic acid
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

149
Patents

277.94836 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.95564 140.4
[M+Na]+ 300.93758 148.8
[M-H]- 276.94108 130.7
[M+NH4]+ 295.98218 155.2
[M+K]+ 316.91152 146.5
[M+H-H2O]+ 260.94562 130.7
[M+HCOO]- 322.94656 145.4
[M+CH3COO]- 336.96221 189.9
[M+Na-2H]- 298.92303 141.8
[M]+ 277.94781 132.6
[M]- 277.94891 132.6
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