CID 121552782

2649064-33-3

Structural Information

Molecular Formula
C6H15N3O3S2
SMILES
CS(=NS(=O)(=O)N1CCNCC1)(=O)C
InChI
InChI=1S/C6H15N3O3S2/c1-13(2,10)8-14(11,12)9-5-3-7-4-6-9/h7H,3-6H2,1-2H3
InChIKey
JNKDVHCXMYEOJO-UHFFFAOYSA-N
Compound name
N-[dimethyl(oxo)-lambda6-sulfanylidene]piperazine-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.05548 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.062756 151.8
[M+Na]+ 264.044698 157.9
[M-H]- 240.048204 151.5
[M+NH4]+ 259.089303 166.4
[M+K]+ 280.018638 154.1
[M+H-H2O]+ 224.052740 145.4
[M+HCOO]- 286.053681 158.8
[M+CH3COO]- 300.069331 185.3
[M+Na-2H]- 262.030146 155.3
[M]+ 241.05493142 149.6
[M]- 241.05602858 149.6
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.