CID 3067942

Imidazo(2,1-b)thiazole, 5,6-dihydro-3-(4-butoxy-3-chlorophenyl)-, monohydrochloride

Structural Information

Molecular Formula
C15H17ClN2OS
SMILES
CCCCOC1=C(C=C(C=C1)C2=CSC3=NCCN23)Cl
InChI
InChI=1S/C15H17ClN2OS/c1-2-3-8-19-14-5-4-11(9-12(14)16)13-10-20-15-17-6-7-18(13)15/h4-5,9-10H,2-3,6-8H2,1H3
InChIKey
PBLXONZBBYAPNZ-UHFFFAOYSA-N
Compound name
3-(4-butoxy-3-chlorophenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

308.075 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.08228 171.5
[M+Na]+ 331.06422 182.1
[M-H]- 307.06772 177.2
[M+NH4]+ 326.10882 190.4
[M+K]+ 347.03816 176.6
[M+H-H2O]+ 291.07226 164.9
[M+HCOO]- 353.07320 183.7
[M+CH3COO]- 367.08885 183.4
[M+Na-2H]- 329.04967 169.7
[M]+ 308.07445 178.1
[M]- 308.07555 178.1
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

patents stripe