CID 71246

Flosulide

Structural Information

Molecular Formula
C16H13F2NO4S
SMILES
CS(=O)(=O)NC1=C(C=C2C(=C1)CCC2=O)OC3=C(C=C(C=C3)F)F
InChI
InChI=1S/C16H13F2NO4S/c1-24(21,22)19-13-6-9-2-4-14(20)11(9)8-16(13)23-15-5-3-10(17)7-12(15)18/h3,5-8,19H,2,4H2,1H3
InChIKey
CXJONBHNIJFARE-UHFFFAOYSA-N
Compound name
N-[6-(2,4-difluorophenoxy)-1-oxo-2,3-dihydroinden-5-yl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

33
References

3849
Patents

353.05334 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.06062 175.4
[M+Na]+ 376.04256 185.8
[M-H]- 352.04606 181.4
[M+NH4]+ 371.08716 191.7
[M+K]+ 392.01650 180.7
[M+H-H2O]+ 336.05060 167.5
[M+HCOO]- 398.05154 191.7
[M+CH3COO]- 412.06719 212.3
[M+Na-2H]- 374.02801 176.9
[M]+ 353.05279 178.2
[M]- 353.05389 178.2
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