CID 1612034

130623-64-2

Structural Information

Molecular Formula
C14H15BrN2OS
SMILES
CCCOC1=C(C=C(C=C1)Br)C2=CSC3=NCCN23
InChI
InChI=1S/C14H15BrN2OS/c1-2-7-18-13-4-3-10(15)8-11(13)12-9-19-14-16-5-6-17(12)14/h3-4,8-9H,2,5-7H2,1H3
InChIKey
UPYVUILNRFRLEC-UHFFFAOYSA-N
Compound name
3-(5-bromo-2-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.00885 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.01613 166.8
[M+Na]+ 360.99807 169.8
[M+NH4]+ 356.04267 172.1
[M+K]+ 376.97201 169.9
[M-H]- 337.00157 168.3
[M+Na-2H]- 358.98352 168.9
[M]+ 338.00830 166.9
[M]- 338.00940 166.9
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.