CID 135450278

199339-13-4

Structural Information

Molecular Formula
C17H11FN4O2S
SMILES
C1=CC=C(C=C1)C2C(=O)N/C(=N\C3=NN=C(O3)C4=CC=C(C=C4)F)/S2
InChI
InChI=1S/C17H11FN4O2S/c18-12-8-6-11(7-9-12)15-21-22-16(24-15)20-17-19-14(23)13(25-17)10-4-2-1-3-5-10/h1-9,13H,(H,19,20,22,23)
InChIKey
WOOLGDVOKSJPOA-UHFFFAOYSA-N
Compound name
(2E)-2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]imino]-5-phenyl-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.0587 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.06598 179.5
[M+Na]+ 377.04792 192.4
[M+NH4]+ 372.09252 185.9
[M+K]+ 393.02186 187.4
[M-H]- 353.05142 185.3
[M+Na-2H]- 375.03337 187.3
[M]+ 354.05815 183.2
[M]- 354.05925 183.2
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.