CID 28775678

N-benzylpiperazine-1-sulfonamide hydrochloride

Structural Information

Molecular Formula
C11H17N3O2S
SMILES
C1CN(CCN1)S(=O)(=O)NCC2=CC=CC=C2
InChI
InChI=1S/C11H17N3O2S/c15-17(16,14-8-6-12-7-9-14)13-10-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2
InChIKey
LVRRVSNWUOPCSV-UHFFFAOYSA-N
Compound name
N-benzylpiperazine-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

255.10414 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.11142 155.5
[M+Na]+ 278.09336 160.1
[M-H]- 254.09686 157.0
[M+NH4]+ 273.13796 168.5
[M+K]+ 294.06730 155.5
[M+H-H2O]+ 238.10140 147.4
[M+HCOO]- 300.10234 167.7
[M+CH3COO]- 314.11799 188.5
[M+Na-2H]- 276.07881 160.2
[M]+ 255.10359 150.8
[M]- 255.10469 150.8
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