CID 11230586

4-benzylpiperazine-1-sulfonamide

Structural Information

Molecular Formula
C11H17N3O2S
SMILES
C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)N
InChI
InChI=1S/C11H17N3O2S/c12-17(15,16)14-8-6-13(7-9-14)10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H2,12,15,16)
InChIKey
WZOUGKAXQBUEPB-UHFFFAOYSA-N
Compound name
4-benzylpiperazine-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

255.10414 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.111416 156.4
[M+Na]+ 278.093358 162.4
[M-H]- 254.096864 159.2
[M+NH4]+ 273.137963 170.2
[M+K]+ 294.067298 158.2
[M+H-H2O]+ 238.101400 148.2
[M+HCOO]- 300.102341 169.4
[M+CH3COO]- 314.117991 191.5
[M+Na-2H]- 276.078806 159.7
[M]+ 255.10359142 153.0
[M]- 255.10468858 153.0
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