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]+ 343.127476 178.0
[M+Na]+ 365.109418 187.4
[M-H]- 341.112924 184.2
[M+NH4]+ 360.154023 195.5
[M+K]+ 381.083358 180.8
[M+H-H2O]+ 325.117460 169.7
[M+HCOO]- 387.118401 191.5
[M+CH3COO]- 401.134051 188.6
[M+Na-2H]- 363.094866 176.7
[M]+ 342.11965142 178.2
[M]- 342.12074858 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.