CID 1819991

870554-60-2

Structural Information

Molecular Formula
C18H14ClNO2S
SMILES
CC1=CC=C(C=C1)CN2C(=O)/C(=C/C3=CC=C(C=C3)Cl)/SC2=O
InChI
InChI=1S/C18H14ClNO2S/c1-12-2-4-14(5-3-12)11-20-17(21)16(23-18(20)22)10-13-6-8-15(19)9-7-13/h2-10H,11H2,1H3/b16-10-
InChIKey
KZLKXQJXVRKSKW-YBEGLDIGSA-N
Compound name
(5Z)-5-[(4-chlorophenyl)methylidene]-3-[(4-methylphenyl)methyl]-1,3-thiazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

343.04337 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.05065 179.3
[M+Na]+ 366.03259 194.6
[M+NH4]+ 361.07719 187.9
[M+K]+ 382.00653 185.1
[M-H]- 342.03609 184.7
[M+Na-2H]- 364.01804 186.9
[M]+ 343.04282 183.8
[M]- 343.04392 183.8
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.