CID 121552643

7-oxabicyclo[2.2.1]heptane-2-sulfonamide

Structural Information

Molecular Formula
C6H11NO3S
SMILES
C1CC2C(CC1O2)S(=O)(=O)N
InChI
InChI=1S/C6H11NO3S/c7-11(8,9)6-3-4-1-2-5(6)10-4/h4-6H,1-3H2,(H2,7,8,9)
InChIKey
GJJRBQXKNGFCRJ-UHFFFAOYSA-N
Compound name
7-oxabicyclo[2.2.1]heptane-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.04596 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.053236 134.9
[M+Na]+ 200.035178 143.4
[M-H]- 176.038684 138.4
[M+NH4]+ 195.079783 159.1
[M+K]+ 216.009118 143.2
[M+H-H2O]+ 160.043220 132.4
[M+HCOO]- 222.044161 151.2
[M+CH3COO]- 236.059811 176.5
[M+Na-2H]- 198.020626 139.1
[M]+ 177.04541142 136.2
[M]- 177.04650858 136.2
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.