CID 21498346

2,2,3,3-tetrafluoropropane-1-sulfonyl chloride

Structural Information

Molecular Formula
C3H3ClF4O2S
SMILES
C(C(C(F)F)(F)F)S(=O)(=O)Cl
InChI
InChI=1S/C3H3ClF4O2S/c4-11(9,10)1-3(7,8)2(5)6/h2H,1H2
InChIKey
NVFNFJVPKWOWLY-UHFFFAOYSA-N
Compound name
2,2,3,3-tetrafluoropropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

213.94785 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.95513 128.0
[M+Na]+ 236.93707 137.9
[M-H]- 212.94057 124.0
[M+NH4]+ 231.98167 147.8
[M+K]+ 252.91101 134.7
[M+H-H2O]+ 196.94511 121.8
[M+HCOO]- 258.94605 135.6
[M+CH3COO]- 272.96170 180.8
[M+Na-2H]- 234.92252 131.2
[M]+ 213.94730 126.9
[M]- 213.94840 126.9
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