CID 204725

Benzenesulfonamide, n-(4-piperidino-2-butynyl)-, monohydrochloride

Structural Information

Molecular Formula
C15H20N2O2S
SMILES
C1CCN(CC1)CC#CCNS(=O)(=O)C2=CC=CC=C2
InChI
InChI=1S/C15H20N2O2S/c18-20(19,15-9-3-1-4-10-15)16-11-5-8-14-17-12-6-2-7-13-17/h1,3-4,9-10,16H,2,6-7,11-14H2
InChIKey
XKLWJTWJAGJOPZ-UHFFFAOYSA-N
Compound name
N-(4-piperidin-1-ylbut-2-ynyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.12454 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.131816 174.1
[M+Na]+ 315.113758 180.8
[M-H]- 291.117264 176.3
[M+NH4]+ 310.158363 186.1
[M+K]+ 331.087698 174.6
[M+H-H2O]+ 275.121800 160.1
[M+HCOO]- 337.122741 182.6
[M+CH3COO]- 351.138391 203.7
[M+Na-2H]- 313.099206 175.6
[M]+ 292.12399142 166.1
[M]- 292.12508858 166.1
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.