CID 45080610

Bicyclo[2.2.2]octane-2-sulfonamide

Structural Information

Molecular Formula
C8H15NO2S
SMILES
C1CC2CCC1CC2S(=O)(=O)N
InChI
InChI=1S/C8H15NO2S/c9-12(10,11)8-5-6-1-3-7(8)4-2-6/h6-8H,1-5H2,(H2,9,10,11)
InChIKey
SQHPJINMVYXBNQ-UHFFFAOYSA-N
Compound name
bicyclo[2.2.2]octane-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

189.08235 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.08963 138.2
[M+Na]+ 212.07157 142.5
[M-H]- 188.07507 134.0
[M+NH4]+ 207.11617 162.1
[M+K]+ 228.04551 140.9
[M+H-H2O]+ 172.07961 135.4
[M+HCOO]- 234.08055 145.1
[M+CH3COO]- 248.09620 185.6
[M+Na-2H]- 210.05702 148.8
[M]+ 189.08180 139.5
[M]- 189.08290 139.5
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

patents stripe