CID 155819590

2470440-46-9

Structural Information

Molecular Formula
C7H11ClF2O3S
SMILES
COC1(CCC1)C(CS(=O)(=O)Cl)(F)F
InChI
InChI=1S/C7H11ClF2O3S/c1-13-6(3-2-4-6)7(9,10)5-14(8,11)12/h2-5H2,1H3
InChIKey
NXHXSXDUBOURIU-UHFFFAOYSA-N
Compound name
2,2-difluoro-2-(1-methoxycyclobutyl)ethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.00854 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.01582 139.8
[M+Na]+ 270.99776 146.6
[M-H]- 247.00126 140.8
[M+NH4]+ 266.04236 153.5
[M+K]+ 286.97170 146.5
[M+H-H2O]+ 231.00580 130.3
[M+HCOO]- 293.00674 147.9
[M+CH3COO]- 307.02239 189.0
[M+Na-2H]- 268.98321 144.7
[M]+ 248.00799 150.7
[M]- 248.00909 150.7
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.