CID 165640306

3-(fluorosulfonyl)azetidine-1-carbonyl chloride

Structural Information

Molecular Formula
C4H5ClFNO3S
SMILES
C1C(CN1C(=O)Cl)S(=O)(=O)F
InChI
InChI=1S/C4H5ClFNO3S/c5-4(8)7-1-3(2-7)11(6,9)10/h3H,1-2H2
InChIKey
XRMQOIGFQYLNAK-UHFFFAOYSA-N
Compound name
3-fluorosulfonylazetidine-1-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.96626 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.97354 126.5
[M+Na]+ 223.95548 134.3
[M-H]- 199.95898 127.7
[M+NH4]+ 219.00008 139.0
[M+K]+ 239.92942 134.7
[M+H-H2O]+ 183.96352 115.9
[M+HCOO]- 245.96446 135.9
[M+CH3COO]- 259.98011 180.6
[M+Na-2H]- 221.94093 129.2
[M]+ 200.96571 137.0
[M]- 200.96681 137.0
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.