CID 183091

2-pyrrolidinone, 5-ethoxy-1-(3-pyridinylsulfonyl)-

Structural Information

Molecular Formula
C11H14N2O4S
SMILES
CCOC1CCC(=O)N1S(=O)(=O)C2=CN=CC=C2
InChI
InChI=1S/C11H14N2O4S/c1-2-17-11-6-5-10(14)13(11)18(15,16)9-4-3-7-12-8-9/h3-4,7-8,11H,2,5-6H2,1H3
InChIKey
CWFLAPRNRAXEDU-UHFFFAOYSA-N
Compound name
5-ethoxy-1-pyridin-3-ylsulfonylpyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.0674 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.07468 159.8
[M+Na]+ 293.05662 170.0
[M+NH4]+ 288.10122 165.8
[M+K]+ 309.03056 165.5
[M-H]- 269.06012 159.9
[M+Na-2H]- 291.04207 164.1
[M]+ 270.06685 161.5
[M]- 270.06795 161.5
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.