CID 28706833

4-(aminomethyl)-n,n-dimethylpiperidine-1-sulfonamide hydrochloride

Structural Information

Molecular Formula
C8H19N3O2S
SMILES
CN(C)S(=O)(=O)N1CCC(CC1)CN
InChI
InChI=1S/C8H19N3O2S/c1-10(2)14(12,13)11-5-3-8(7-9)4-6-11/h8H,3-7,9H2,1-2H3
InChIKey
WBWPLOPHZFHPPQ-UHFFFAOYSA-N
Compound name
4-(aminomethyl)-N,N-dimethylpiperidine-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.1198 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.12708 148.1
[M+Na]+ 244.10902 153.0
[M-H]- 220.11252 150.5
[M+NH4]+ 239.15362 165.3
[M+K]+ 260.08296 151.8
[M+H-H2O]+ 204.11706 141.3
[M+HCOO]- 266.11800 163.0
[M+CH3COO]- 280.13365 192.4
[M+Na-2H]- 242.09447 150.1
[M]+ 221.11925 146.1
[M]- 221.12035 146.1
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.