CID 76848570

5-bromoimidazo[2,1-b][1,3]thiazole

Structural Information

Molecular Formula
C5H3BrN2S
SMILES
C1=CSC2=NC=C(N21)Br
InChI
InChI=1S/C5H3BrN2S/c6-4-3-7-5-8(4)1-2-9-5/h1-3H
InChIKey
GUMIYPXTEYKCBT-UHFFFAOYSA-N
Compound name
5-bromoimidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

201.92003 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.92731 124.6
[M+Na]+ 224.90925 141.9
[M-H]- 200.91275 131.5
[M+NH4]+ 219.95385 151.0
[M+K]+ 240.88319 131.9
[M+H-H2O]+ 184.91729 126.3
[M+HCOO]- 246.91823 144.4
[M+CH3COO]- 260.93388 142.8
[M+Na-2H]- 222.89470 131.6
[M]+ 201.91948 147.7
[M]- 201.92058 147.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe