CID 477918

Imidazo[2,1-b]thiazole, 6-[3-(trifluoromethyl)phenyl]-

Structural Information

Molecular Formula
C12H7F3N2S
SMILES
C1=CC(=CC(=C1)C(F)(F)F)C2=CN3C=CSC3=N2
InChI
InChI=1S/C12H7F3N2S/c13-12(14,15)9-3-1-2-8(6-9)10-7-17-4-5-18-11(17)16-10/h1-7H
InChIKey
IFSVKARILHYNCH-UHFFFAOYSA-N
Compound name
6-[3-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

268.0282 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.03548 152.8
[M+Na]+ 291.01742 166.3
[M-H]- 267.02092 156.1
[M+NH4]+ 286.06202 172.7
[M+K]+ 306.99136 161.0
[M+H-H2O]+ 251.02546 144.3
[M+HCOO]- 313.02640 168.9
[M+CH3COO]- 327.04205 166.1
[M+Na-2H]- 289.00287 154.9
[M]+ 268.02765 154.3
[M]- 268.02875 154.3
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

No patent data available for this compound.