CID 54592823

2-amino-n-[(oxan-2-yl)methyl]ethane-1-sulfonamide hydrochloride

Structural Information

Molecular Formula
C8H18N2O3S
SMILES
C1CCOC(C1)CNS(=O)(=O)CCN
InChI
InChI=1S/C8H18N2O3S/c9-4-6-14(11,12)10-7-8-3-1-2-5-13-8/h8,10H,1-7,9H2
InChIKey
ODQAGUFXTZQBLG-UHFFFAOYSA-N
Compound name
2-amino-N-(oxan-2-ylmethyl)ethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.10382 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.111096 147.1
[M+Na]+ 245.093038 150.8
[M-H]- 221.096544 149.6
[M+NH4]+ 240.137643 163.2
[M+K]+ 261.066978 149.7
[M+H-H2O]+ 205.101080 140.7
[M+HCOO]- 267.102021 162.3
[M+CH3COO]- 281.117671 187.4
[M+Na-2H]- 243.078486 151.4
[M]+ 222.10327142 144.8
[M]- 222.10436858 144.8
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

No patent data available for this compound.