CID 73224

36103-99-8

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
1
Annotation Hits

3
References

17
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

literature stripe

Patent stripe

patents stripe