CID 479459

N-sulfamoyloctane-1-sulfonamide

Structural Information

Molecular Formula
C8H20N2O4S2
SMILES
CCCCCCCCS(=O)(=O)NS(=O)(=O)N
InChI
InChI=1S/C8H20N2O4S2/c1-2-3-4-5-6-7-8-15(11,12)10-16(9,13)14/h10H,2-8H2,1H3,(H2,9,13,14)
InChIKey
QBRDTDXONCNDEB-UHFFFAOYSA-N
Compound name
N-sulfamoyloctane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

272.08646 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.09374 159.6
[M+Na]+ 295.07568 164.5
[M-H]- 271.07918 158.0
[M+NH4]+ 290.12028 174.9
[M+K]+ 311.04962 160.0
[M+H-H2O]+ 255.08372 153.0
[M+HCOO]- 317.08466 170.9
[M+CH3COO]- 331.10031 196.3
[M+Na-2H]- 293.06113 161.9
[M]+ 272.08591 162.8
[M]- 272.08701 162.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.