CID 472922

2-chloro-6-(2,5-dimethoxyphenyl)imidazo[2,1-b]thiazole

Structural Information

Molecular Formula
C13H11ClN2O2S
SMILES
COC1=CC(=C(C=C1)OC)C2=CN3C=C(SC3=N2)Cl
InChI
InChI=1S/C13H11ClN2O2S/c1-17-8-3-4-11(18-2)9(5-8)10-6-16-7-12(14)19-13(16)15-10/h3-7H,1-2H3
InChIKey
NFYXHYDNPFAYHR-UHFFFAOYSA-N
Compound name
2-chloro-6-(2,5-dimethoxyphenyl)imidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

294.02298 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.03026 163.6
[M+Na]+ 317.01220 177.8
[M-H]- 293.01570 171.0
[M+NH4]+ 312.05680 183.6
[M+K]+ 332.98614 172.8
[M+H-H2O]+ 277.02024 157.8
[M+HCOO]- 339.02118 179.5
[M+CH3COO]- 353.03683 177.7
[M+Na-2H]- 314.99765 164.2
[M]+ 294.02243 174.2
[M]- 294.02353 174.2
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.