CID 503763

2-(2,6-difluorophenyl)-3-(3,5-difluorophenyl)thiazolidin-4-one

Structural Information

Molecular Formula
C15H9F4NOS
SMILES
C1C(=O)N(C(S1)C2=C(C=CC=C2F)F)C3=CC(=CC(=C3)F)F
InChI
InChI=1S/C15H9F4NOS/c16-8-4-9(17)6-10(5-8)20-13(21)7-22-15(20)14-11(18)2-1-3-12(14)19/h1-6,15H,7H2
InChIKey
KHJLVDPIWBPQIW-UHFFFAOYSA-N
Compound name
2-(2,6-difluorophenyl)-3-(3,5-difluorophenyl)-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

327.0341 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.04138 166.5
[M+Na]+ 350.02332 178.4
[M-H]- 326.02682 171.1
[M+NH4]+ 345.06792 182.2
[M+K]+ 365.99726 171.3
[M+H-H2O]+ 310.03136 155.7
[M+HCOO]- 372.03230 179.8
[M+CH3COO]- 386.04795 177.9
[M+Na-2H]- 348.00877 162.4
[M]+ 327.03355 163.4
[M]- 327.03465 163.4
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.