CID 285501

1-(1-piperidinylsulfonyl)piperazine

Structural Information

Molecular Formula
C9H19N3O2S
SMILES
C1CCN(CC1)S(=O)(=O)N2CCNCC2
InChI
InChI=1S/C9H19N3O2S/c13-15(14,11-6-2-1-3-7-11)12-8-4-10-5-9-12/h10H,1-9H2
InChIKey
DRAVEXQQEXRRDS-UHFFFAOYSA-N
Compound name
1-piperidin-1-ylsulfonylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

29
Patents

233.1198 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.12708 153.5
[M+Na]+ 256.10902 156.8
[M-H]- 232.11252 152.9
[M+NH4]+ 251.15362 166.1
[M+K]+ 272.08296 153.5
[M+H-H2O]+ 216.11706 145.3
[M+HCOO]- 278.11800 159.7
[M+CH3COO]- 292.13365 181.7
[M+Na-2H]- 254.09447 155.3
[M]+ 233.11925 145.2
[M]- 233.12035 145.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe