CID 50988744

Piperidin-3-ylmethanesulfonamide

Structural Information

Molecular Formula
C6H14N2O2S
SMILES
C1CC(CNC1)CS(=O)(=O)N
InChI
InChI=1S/C6H14N2O2S/c7-11(9,10)5-6-2-1-3-8-4-6/h6,8H,1-5H2,(H2,7,9,10)
InChIKey
MVSCEWQFNYYHBS-UHFFFAOYSA-N
Compound name
piperidin-3-ylmethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

178.0776 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.084876 137.0
[M+Na]+ 201.066818 142.2
[M-H]- 177.070324 136.6
[M+NH4]+ 196.111423 154.6
[M+K]+ 217.040758 139.3
[M+H-H2O]+ 161.074860 131.2
[M+HCOO]- 223.075801 149.7
[M+CH3COO]- 237.091451 174.2
[M+Na-2H]- 199.052266 140.1
[M]+ 178.07705142 131.5
[M]- 178.07814858 131.5
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