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]+ 293.13182 174.1
[M+Na]+ 315.11376 180.8
[M-H]- 291.11726 176.3
[M+NH4]+ 310.15836 186.1
[M+K]+ 331.08770 174.6
[M+H-H2O]+ 275.12180 160.1
[M+HCOO]- 337.12274 182.6
[M+CH3COO]- 351.13839 203.7
[M+Na-2H]- 313.09921 175.6
[M]+ 292.12399 166.1
[M]- 292.12509 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.