CID 12663632

Pentafluoroethanesulfinic acid

Structural Information

Molecular Formula
C2HF5O2S
SMILES
C(C(F)(F)S(=O)O)(F)(F)F
InChI
InChI=1S/C2HF5O2S/c3-1(4,5)2(6,7)10(8)9/h(H,8,9)
InChIKey
MOFLIWVSDXPEDX-UHFFFAOYSA-N
Compound name
1,1,2,2,2-pentafluoroethanesulfinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

93
Patents

183.96175 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.96903 123.8
[M+Na]+ 206.95097 132.8
[M-H]- 182.95447 116.9
[M+NH4]+ 201.99557 143.0
[M+K]+ 222.92491 131.1
[M+H-H2O]+ 166.95901 115.9
[M+HCOO]- 228.95995 133.1
[M+CH3COO]- 242.97560 174.5
[M+Na-2H]- 204.93642 126.4
[M]+ 183.96120 117.8
[M]- 183.96230 117.8
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.