CID 48201

2-ethyl-2-(ethylsulfonyl)butyramide

Structural Information

Molecular Formula
C8H17NO3S
SMILES
CCC(CC)(C(=O)N)S(=O)(=O)CC
InChI
InChI=1S/C8H17NO3S/c1-4-8(5-2,7(9)10)13(11,12)6-3/h4-6H2,1-3H3,(H2,9,10)
InChIKey
CASHSQLBCKRRLY-UHFFFAOYSA-N
Compound name
2-ethyl-2-ethylsulfonylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.09291 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.10019 148.8
[M+Na]+ 230.08213 155.3
[M+NH4]+ 225.12673 154.2
[M+K]+ 246.05607 151.0
[M-H]- 206.08563 145.7
[M+Na-2H]- 228.06758 149.3
[M]+ 207.09236 148.9
[M]- 207.09346 148.9
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.