CID 165941155

3-[(chlorocarbonyl)oxy]propane-1-sulfonyl fluoride

Structural Information

Molecular Formula
C4H6ClFO4S
SMILES
C(COC(=O)Cl)CS(=O)(=O)F
InChI
InChI=1S/C4H6ClFO4S/c5-4(7)10-2-1-3-11(6,8)9/h1-3H2
InChIKey
PGIGJLPZQRESJE-UHFFFAOYSA-N
Compound name
3-fluorosulfonylpropyl carbonochloridate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.96594 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.97322 132.4
[M+Na]+ 226.95516 141.7
[M-H]- 202.95866 132.2
[M+NH4]+ 221.99976 152.7
[M+K]+ 242.92910 139.4
[M+H-H2O]+ 186.96320 128.3
[M+HCOO]- 248.96414 144.9
[M+CH3COO]- 262.97979 177.3
[M+Na-2H]- 224.94061 136.0
[M]+ 203.96539 138.0
[M]- 203.96649 138.0
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

No patent data available for this compound.