CID 329950

23576-84-3

Structural Information

Molecular Formula

C₆H₃ClN₂OS

SMILES

C1=CSC2=NC(=C(N21)C=O)Cl

InChI

InChI=1S/C6H3ClN2OS/c7-5-4(3-10)9-1-2-11-6(9)8-5/h1-3H

InChIKey

ZUBBEEJDPFMKHA-UHFFFAOYSA-N

Compound name

6-chloroimidazo[2,1-b][1,3]thiazole-5-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 59
Patents: 185.96545 Da
Monoisotopic Mass: 2.6
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]+	186.97273	134.2
[M+Na]+	208.95467	147.7
[M+NH4]+	203.99927	143.6
[M+K]+	224.92861	142.4
[M-H]-	184.95817	135.1
[M+Na-2H]-	206.94012	139.3
[M]+	185.96490	137.1
[M]-	185.96600	137.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe