CID 466374

Schembl3637268

Structural Information

Molecular Formula
C11H6Cl2N2S
SMILES
C1=CC(=CC=C1C2=CN3C=C(SC3=N2)Cl)Cl
InChI
InChI=1S/C11H6Cl2N2S/c12-8-3-1-7(2-4-8)9-5-15-6-10(13)16-11(15)14-9/h1-6H
InChIKey
ZIUZFYACYGONMS-UHFFFAOYSA-N
Compound name
2-chloro-6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

10
Patents

267.96286 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.97014 155.8
[M+Na]+ 290.95208 170.7
[M-H]- 266.95558 162.2
[M+NH4]+ 285.99668 176.9
[M+K]+ 306.92602 164.1
[M+H-H2O]+ 250.96012 150.2
[M+HCOO]- 312.96106 166.6
[M+CH3COO]- 326.97671 169.8
[M+Na-2H]- 288.93753 156.8
[M]+ 267.96231 163.3
[M]- 267.96341 163.3
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.