CID 6449139

129228-63-3

Structural Information

Molecular Formula
C12H9ClN2OS
SMILES
C1CSC2=N/C(=C/C3=CC=C(C=C3)Cl)/C(=O)N21
InChI
InChI=1S/C12H9ClN2OS/c13-9-3-1-8(2-4-9)7-10-11(16)15-5-6-17-12(15)14-10/h1-4,7H,5-6H2/b10-7+
InChIKey
OMWVQYRUAQMEGW-JXMROGBWSA-N
Compound name
(6E)-6-[(4-chlorophenyl)methylidene]-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.01242 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.01970 156.9
[M+Na]+ 287.00164 170.0
[M+NH4]+ 282.04624 166.2
[M+K]+ 302.97558 163.6
[M-H]- 263.00514 159.7
[M+Na-2H]- 284.98709 161.9
[M]+ 264.01187 160.2
[M]- 264.01297 160.2
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.