CID 503758

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

Structural Information

Molecular Formula
C15H9Cl4NOS
SMILES
C1C(=O)N(C(S1)C2=C(C=CC=C2Cl)Cl)C3=CC(=CC(=C3)Cl)Cl
InChI
InChI=1S/C15H9Cl4NOS/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
YTYCIKWMLKIVPY-UHFFFAOYSA-N
Compound name
2-(2,6-dichlorophenyl)-3-(3,5-dichlorophenyl)-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

390.9159 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.92318 183.8
[M+Na]+ 413.90512 194.9
[M-H]- 389.90862 189.6
[M+NH4]+ 408.94972 197.8
[M+K]+ 429.87906 187.6
[M+H-H2O]+ 373.91316 178.4
[M+HCOO]- 435.91410 180.4
[M+CH3COO]- 449.92975 193.0
[M+Na-2H]- 411.89057 178.3
[M]+ 390.91535 186.8
[M]- 390.91645 186.8
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

No patent data available for this compound.