CID 119031497

(4-fluorooxan-4-yl)methanesulfonyl chloride

Structural Information

Molecular Formula
C6H10ClFO3S
SMILES
C1COCCC1(CS(=O)(=O)Cl)F
InChI
InChI=1S/C6H10ClFO3S/c7-12(9,10)5-6(8)1-3-11-4-2-6/h1-5H2
InChIKey
DMZFNYCDNVNASY-UHFFFAOYSA-N
Compound name
(4-fluorooxan-4-yl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.00232 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.00960 136.8
[M+Na]+ 238.99154 144.7
[M-H]- 214.99504 139.7
[M+NH4]+ 234.03614 157.1
[M+K]+ 254.96548 143.1
[M+H-H2O]+ 198.99958 132.9
[M+HCOO]- 261.00052 146.0
[M+CH3COO]- 275.01617 178.1
[M+Na-2H]- 236.97699 142.9
[M]+ 216.00177 137.6
[M]- 216.00287 137.6
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.