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]+ 141.00162 113.1
[M+Na]+ 162.98356 119.8
[M-H]- 138.98706 116.3
[M+NH4]+ 158.02816 127.1
[M+K]+ 178.95750 123.6
[M+H-H2O]+ 122.99160 102.4
[M+HCOO]- 184.99254 128.6
[M+CH3COO]- 199.00819 171.0
[M+Na-2H]- 160.96901 119.3
[M]+ 139.99379 122.6
[M]- 139.99489 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.