CID 28783155

1228070-80-1

Structural Information

Molecular Formula
C9H19N3O3S
SMILES
C1CN(CCC1N)S(=O)(=O)N2CCOCC2
InChI
InChI=1S/C9H19N3O3S/c10-9-1-3-11(4-2-9)16(13,14)12-5-7-15-8-6-12/h9H,1-8,10H2
InChIKey
XYSKGGIRUYMGEO-UHFFFAOYSA-N
Compound name
1-morpholin-4-ylsulfonylpiperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

249.11472 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.12200 154.8
[M+Na]+ 272.10394 158.4
[M-H]- 248.10744 157.4
[M+NH4]+ 267.14854 167.2
[M+K]+ 288.07788 157.1
[M+H-H2O]+ 232.11198 146.9
[M+HCOO]- 294.11292 163.5
[M+CH3COO]- 308.12857 189.0
[M+Na-2H]- 270.08939 157.1
[M]+ 249.11417 148.5
[M]- 249.11527 148.5
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