CID 73224

3-(4-chloro-phenyl)-5,6-dihydro-imidazo[2,1-b]thiazole

Structural Information

Molecular Formula
C11H9ClN2S
SMILES
C1CN2C(=CSC2=N1)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C11H9ClN2S/c12-9-3-1-8(2-4-9)10-7-15-11-13-5-6-14(10)11/h1-4,7H,5-6H2
InChIKey
DFKOPKKSCIVOAK-UHFFFAOYSA-N
Compound name
3-(4-chlorophenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

12
Patents

236.0175 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.02478 150.3
[M+Na]+ 259.00672 162.3
[M-H]- 235.01022 156.5
[M+NH4]+ 254.05132 172.1
[M+K]+ 274.98066 157.1
[M+H-H2O]+ 219.01476 144.3
[M+HCOO]- 281.01570 163.8
[M+CH3COO]- 295.03135 164.0
[M+Na-2H]- 256.99217 151.1
[M]+ 236.01695 153.9
[M]- 236.01805 153.9
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.