CID 122235975

Oxetane-3-sulfonyl fluoride

Structural Information

Molecular Formula
C3H5FO3S
SMILES
C1C(CO1)S(=O)(=O)F
InChI
InChI=1S/C3H5FO3S/c4-8(5,6)3-1-7-2-3/h3H,1-2H2
InChIKey
MPJZKFREQLREHJ-UHFFFAOYSA-N
Compound name
oxetane-3-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.99434 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.001616 113.1
[M+Na]+ 162.983558 119.8
[M-H]- 138.987064 116.3
[M+NH4]+ 158.028163 127.1
[M+K]+ 178.957498 123.6
[M+H-H2O]+ 122.991600 102.4
[M+HCOO]- 184.992541 128.6
[M+CH3COO]- 199.008191 171.0
[M+Na-2H]- 160.969006 119.3
[M]+ 139.99379142 122.6
[M]- 139.99488858 122.6
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

No patent data available for this compound.