CID 155820531

5,5-difluorohexane-1-sulfonylchloride

Structural Information

Molecular Formula
C6H11ClF2O2S
SMILES
CC(CCCCS(=O)(=O)Cl)(F)F
InChI
InChI=1S/C6H11ClF2O2S/c1-6(8,9)4-2-3-5-12(7,10)11/h2-5H2,1H3
InChIKey
MKWQKCYLXLSEPY-UHFFFAOYSA-N
Compound name
5,5-difluorohexane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.01364 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.02092 146.7
[M+Na]+ 243.00286 154.5
[M+NH4]+ 238.04746 152.5
[M+K]+ 258.97680 148.3
[M-H]- 219.00636 141.7
[M+Na-2H]- 240.98831 147.8
[M]+ 220.01309 146.8
[M]- 220.01419 146.8
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.