CID 61067967

2-azabicyclo[2.2.1]heptane-2-sulfonamide

Structural Information

Molecular Formula
C6H12N2O2S
SMILES
C1CC2CC1CN2S(=O)(=O)N
InChI
InChI=1S/C6H12N2O2S/c7-11(9,10)8-4-5-1-2-6(8)3-5/h5-6H,1-4H2,(H2,7,9,10)
InChIKey
CJKSXODBQZXSSL-UHFFFAOYSA-N
Compound name
2-azabicyclo[2.2.1]heptane-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

176.06195 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.069226 137.1
[M+Na]+ 199.051168 145.6
[M-H]- 175.054674 138.6
[M+NH4]+ 194.095773 161.3
[M+K]+ 215.025108 144.2
[M+H-H2O]+ 159.059210 133.3
[M+HCOO]- 221.060151 152.7
[M+CH3COO]- 235.075801 177.0
[M+Na-2H]- 197.036616 139.9
[M]+ 176.06140142 136.9
[M]- 176.06249858 136.9
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