CID 47207535

Sodium starch glycolate (ii)

Structural Information

Molecular Formula
C11H14FNO3S
SMILES
CCCS(=O)(=O)CC(=O)NC1=CC=C(C=C1)F
InChI
InChI=1S/C11H14FNO3S/c1-2-7-17(15,16)8-11(14)13-10-5-3-9(12)4-6-10/h3-6H,2,7-8H2,1H3,(H,13,14)
InChIKey
COTYJDILSJMZTQ-UHFFFAOYSA-N
Compound name
N-(4-fluorophenyl)-2-propylsulfonylacetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

106
References

0
Patents

259.06784 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.07512 156.9
[M+Na]+ 282.05706 165.8
[M+NH4]+ 277.10166 162.8
[M+K]+ 298.03100 159.2
[M-H]- 258.06056 155.9
[M+Na-2H]- 280.04251 160.8
[M]+ 259.06729 158.0
[M]- 259.06839 158.0
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.