CID 65801231

4-(aminomethyl)piperidine-1-sulfonamide hydrochloride

Structural Information

Molecular Formula
C6H15N3O2S
SMILES
C1CN(CCC1CN)S(=O)(=O)N
InChI
InChI=1S/C6H15N3O2S/c7-5-6-1-3-9(4-2-6)12(8,10)11/h6H,1-5,7H2,(H2,8,10,11)
InChIKey
PXGDYVQYFSCAPZ-UHFFFAOYSA-N
Compound name
4-(aminomethyl)piperidine-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

193.0885 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.09578 139.8
[M+Na]+ 216.07772 145.4
[M-H]- 192.08122 140.5
[M+NH4]+ 211.12232 157.1
[M+K]+ 232.05166 142.9
[M+H-H2O]+ 176.08576 133.5
[M+HCOO]- 238.08670 154.3
[M+CH3COO]- 252.10235 182.4
[M+Na-2H]- 214.06317 142.3
[M]+ 193.08795 134.8
[M]- 193.08905 134.8
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