CID 479456

2-[2-(2-ethoxyethoxy)ethylsulfonyl]acetamide

Structural Information

Molecular Formula
C8H17NO5S
SMILES
CCOCCOCCS(=O)(=O)CC(=O)N
InChI
InChI=1S/C8H17NO5S/c1-2-13-3-4-14-5-6-15(11,12)7-8(9)10/h2-7H2,1H3,(H2,9,10)
InChIKey
SBSFWGNQBUAPME-UHFFFAOYSA-N
Compound name
2-[2-(2-ethoxyethoxy)ethylsulfonyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

239.08275 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.09003 151.3
[M+Na]+ 262.07197 157.0
[M-H]- 238.07547 150.6
[M+NH4]+ 257.11657 168.5
[M+K]+ 278.04591 155.9
[M+H-H2O]+ 222.08001 145.4
[M+HCOO]- 284.08095 168.4
[M+CH3COO]- 298.09660 189.9
[M+Na-2H]- 260.05742 153.2
[M]+ 239.08220 157.4
[M]- 239.08330 157.4
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.