CID 4778222

1174143-24-8

Structural Information

Molecular Formula
C11H16N2O2S
SMILES
C1CN(CCC1N)S(=O)(=O)C2=CC=CC=C2
InChI
InChI=1S/C11H16N2O2S/c12-10-6-8-13(9-7-10)16(14,15)11-4-2-1-3-5-11/h1-5,10H,6-9,12H2
InChIKey
JKYZVBQALRYBKE-UHFFFAOYSA-N
Compound name
1-(benzenesulfonyl)piperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

240.09325 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.100526 151.9
[M+Na]+ 263.082468 157.9
[M-H]- 239.085974 156.2
[M+NH4]+ 258.127073 167.7
[M+K]+ 279.056408 154.0
[M+H-H2O]+ 223.090510 144.6
[M+HCOO]- 285.091451 166.2
[M+CH3COO]- 299.107101 188.7
[M+Na-2H]- 261.067916 155.2
[M]+ 240.09270142 148.1
[M]- 240.09379858 148.1
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

patents stripe