CID 55263295

2-fluoropropane-1-sulfonyl chloride

Structural Information

Molecular Formula
C3H6ClFO2S
SMILES
CC(CS(=O)(=O)Cl)F
InChI
InChI=1S/C3H6ClFO2S/c1-3(5)2-8(4,6)7/h3H,2H2,1H3
InChIKey
XSPTVLLUSZGIRW-UHFFFAOYSA-N
Compound name
2-fluoropropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

159.9761 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.983376 122.9
[M+Na]+ 182.965318 132.6
[M-H]- 158.968824 122.9
[M+NH4]+ 178.009923 145.2
[M+K]+ 198.939258 130.2
[M+H-H2O]+ 142.973360 119.3
[M+HCOO]- 204.974301 135.0
[M+CH3COO]- 218.989951 172.0
[M+Na-2H]- 180.950766 126.6
[M]+ 159.97555142 126.0
[M]- 159.97664858 126.0
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

patents stripe