CID 20118568

1829814-29-0

Structural Information

Molecular Formula

C₁₁H₁₆N₂O₂S

SMILES

C1CC(CNC1)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C11H16N2O2S/c14-16(15,11-6-2-1-3-7-11)13-10-5-4-8-12-9-10/h1-3,6-7,10,12-13H,4-5,8-9H2

InChIKey

CBUATOLLDLLJAN-UHFFFAOYSA-N

Compound name

N-piperidin-3-ylbenzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 240.09325 Da
Monoisotopic Mass: 1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	241.10053	151.3
[M+Na]+	263.08247	155.9
[M-H]-	239.08597	154.2
[M+NH4]+	258.12707	166.3
[M+K]+	279.05641	151.4
[M+H-H2O]+	223.09051	144.0
[M+HCOO]-	285.09145	164.7
[M+CH3COO]-	299.10710	185.7
[M+Na-2H]-	261.06792	155.9
[M]+	240.09270	146.2
[M]-	240.09380	146.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe