CID 25058720

2-(2,6-dichlorophenyl)-3-[(5-methyl-2-furyl)methyl]thiazolidin-4-one

Structural Information

Molecular Formula
C15H13Cl2NO2S
SMILES
CC1=CC=C(O1)CN2C(SCC2=O)C3=C(C=CC=C3Cl)Cl
InChI
InChI=1S/C15H13Cl2NO2S/c1-9-5-6-10(20-9)7-18-13(19)8-21-15(18)14-11(16)3-2-4-12(14)17/h2-6,15H,7-8H2,1H3
InChIKey
ACPGKCLVTXAFOT-UHFFFAOYSA-N
Compound name
2-(2,6-dichlorophenyl)-3-[(5-methylfuran-2-yl)methyl]-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

341.0044 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.01168 178.7
[M+Na]+ 363.99362 190.3
[M-H]- 339.99712 188.6
[M+NH4]+ 359.03822 195.7
[M+K]+ 379.96756 184.8
[M+H-H2O]+ 324.00166 173.5
[M+HCOO]- 386.00260 186.6
[M+CH3COO]- 400.01825 190.8
[M+Na-2H]- 361.97907 174.0
[M]+ 341.00385 185.0
[M]- 341.00495 185.0
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.