CID 486674

4-thiazolidinone, 2-(2,6-dichlorophenyl)-3-phenyl-

Structural Information

Molecular Formula
C15H11Cl2NOS
SMILES
C1C(=O)N(C(S1)C2=C(C=CC=C2Cl)Cl)C3=CC=CC=C3
InChI
InChI=1S/C15H11Cl2NOS/c16-11-7-4-8-12(17)14(11)15-18(13(19)9-20-15)10-5-2-1-3-6-10/h1-8,15H,9H2
InChIKey
VNCIVACCVYSJKD-UHFFFAOYSA-N
Compound name
2-(2,6-dichlorophenyl)-3-phenyl-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

322.99384 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.00112 170.7
[M+Na]+ 345.98306 181.6
[M-H]- 321.98656 179.2
[M+NH4]+ 341.02766 187.6
[M+K]+ 361.95700 174.1
[M+H-H2O]+ 305.99110 164.3
[M+HCOO]- 367.99204 178.5
[M+CH3COO]- 382.00769 182.4
[M+Na-2H]- 343.96851 168.8
[M]+ 322.99329 174.0
[M]- 322.99439 174.0
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.