CID 1205513

107255-69-6

Structural Information

Molecular Formula
C15H15FN2O2S2
SMILES
C1COCCN1CN2C(=O)/C(=C\C3=CC=C(C=C3)F)/SC2=S
InChI
InChI=1S/C15H15FN2O2S2/c16-12-3-1-11(2-4-12)9-13-14(19)18(15(21)22-13)10-17-5-7-20-8-6-17/h1-4,9H,5-8,10H2/b13-9+
InChIKey
MLINQFCXYMQZBL-UKTHLTGXSA-N
Compound name
(5E)-5-[(4-fluorophenyl)methylidene]-3-(morpholin-4-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.0559 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.06318 176.6
[M+Na]+ 361.04512 186.9
[M+NH4]+ 356.08972 183.5
[M+K]+ 377.01906 178.3
[M-H]- 337.04862 180.3
[M+Na-2H]- 359.03057 179.7
[M]+ 338.05535 179.8
[M]- 338.05645 179.8
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.