CID 45158653

2-bromoimidazo[2,1-b]thiazole

Structural Information

Molecular Formula

C₅H₃BrN₂S

SMILES

C1=CN2C=C(SC2=N1)Br

InChI

InChI=1S/C5H3BrN2S/c6-4-3-8-2-1-7-5(8)9-4/h1-3H

InChIKey

XEEFWBXJKDWNCM-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 201.92003 Da
Monoisotopic Mass: 2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	202.92731	129.1
[M+Na]+	224.90925	132.6
[M+NH4]+	219.95385	135.3
[M+K]+	240.88319	133.8
[M-H]-	200.91275	129.2
[M+Na-2H]-	222.89470	132.1
[M]+	201.91948	128.8
[M]-	201.92058	128.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.