CID 3070337

86346-83-0

Structural Information

Molecular Formula
C19H19FN2OS
SMILES
C1CN2C(=N1)SC(C2(C3=CC=CC=C3F)O)CCC4=CC=CC=C4
InChI
InChI=1S/C19H19FN2OS/c20-16-9-5-4-8-15(16)19(23)17(24-18-21-12-13-22(18)19)11-10-14-6-2-1-3-7-14/h1-9,17,23H,10-13H2
InChIKey
IVKXYLBLLZHPBC-UHFFFAOYSA-N
Compound name
3-(2-fluorophenyl)-2-(2-phenylethyl)-5,6-dihydro-2H-imidazo[2,1-b][1,3]thiazol-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.1202 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.12748 178.0
[M+Na]+ 365.10942 187.4
[M-H]- 341.11292 184.2
[M+NH4]+ 360.15402 195.5
[M+K]+ 381.08336 180.8
[M+H-H2O]+ 325.11746 169.7
[M+HCOO]- 387.11840 191.5
[M+CH3COO]- 401.13405 188.6
[M+Na-2H]- 363.09487 176.7
[M]+ 342.11965 178.2
[M]- 342.12075 178.2
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.