CID 112686109

N-(oxan-4-yl)aminosulfonamide

Structural Information

Molecular Formula
C5H12N2O3S
SMILES
C1COCCC1NS(=O)(=O)N
InChI
InChI=1S/C5H12N2O3S/c6-11(8,9)7-5-1-3-10-4-2-5/h5,7H,1-4H2,(H2,6,8,9)
InChIKey
DRBVAWQDPGGWIH-UHFFFAOYSA-N
Compound name
4-(sulfamoylamino)oxane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

180.05687 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.06415 134.1
[M+Na]+ 203.04609 139.1
[M-H]- 179.04959 137.2
[M+NH4]+ 198.09069 151.8
[M+K]+ 219.02003 138.6
[M+H-H2O]+ 163.05413 128.2
[M+HCOO]- 225.05507 150.2
[M+CH3COO]- 239.07072 178.3
[M+Na-2H]- 201.03154 139.7
[M]+ 180.05632 130.7
[M]- 180.05742 130.7
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