CID 112639863

(4,4-difluorocyclohexyl)methanesulfonamide

Structural Information

Molecular Formula
C7H13F2NO2S
SMILES
C1CC(CCC1CS(=O)(=O)N)(F)F
InChI
InChI=1S/C7H13F2NO2S/c8-7(9)3-1-6(2-4-7)5-13(10,11)12/h6H,1-5H2,(H2,10,11,12)
InChIKey
RLWQXEWBKNBBGJ-UHFFFAOYSA-N
Compound name
(4,4-difluorocyclohexyl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.0635 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.07078 144.2
[M+Na]+ 236.05272 150.6
[M+NH4]+ 231.09732 151.6
[M+K]+ 252.02666 143.2
[M-H]- 212.05622 141.8
[M+Na-2H]- 234.03817 147.7
[M]+ 213.06295 144.6
[M]- 213.06405 144.6
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.