CID 170914406

6-bromoimidazo(2,1-b)(1,3)thiazole-2-carbaldehyde

Structural Information

Molecular Formula
C6H3BrN2OS
SMILES
C1=C(SC2=NC(=CN21)Br)C=O
InChI
InChI=1S/C6H3BrN2OS/c7-5-2-9-1-4(3-10)11-6(9)8-5/h1-3H
InChIKey
RTFNQOZYCXABFK-UHFFFAOYSA-N
Compound name
6-bromoimidazo[2,1-b][1,3]thiazole-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.91495 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.92223 136.7
[M+Na]+ 252.90417 139.9
[M+NH4]+ 247.94877 142.0
[M+K]+ 268.87811 141.4
[M-H]- 228.90767 136.1
[M+Na-2H]- 250.88962 138.7
[M]+ 229.91440 136.1
[M]- 229.91550 136.1
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

No patent data available for this compound.