CID 164009

116686-15-8

Structural Information

Molecular Formula
C15H13F2NO4S
SMILES
CC(=O)C1=CC(=C(C=C1)NS(=O)(=O)C)OC2=C(C=C(C=C2)F)F
InChI
InChI=1S/C15H13F2NO4S/c1-9(19)10-3-5-13(18-23(2,20)21)15(7-10)22-14-6-4-11(16)8-12(14)17/h3-8,18H,1-2H3
InChIKey
DIIYLGZNZGPXRR-UHFFFAOYSA-N
Compound name
N-[4-acetyl-2-(2,4-difluorophenoxy)phenyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

16
References

98
Patents

341.05334 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.06062 176.0
[M+Na]+ 364.04256 186.2
[M+NH4]+ 359.08716 180.8
[M+K]+ 380.01650 179.5
[M-H]- 340.04606 175.7
[M+Na-2H]- 362.02801 181.0
[M]+ 341.05279 177.5
[M]- 341.05389 177.5
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

patents stripe