CID 3070331

86346-80-7

Structural Information

Molecular Formula
C20H22N2OS
SMILES
CC1=CC=CC=C1C2(C(SC3=NCCN32)CCC4=CC=CC=C4)O
InChI
InChI=1S/C20H22N2OS/c1-15-7-5-6-10-17(15)20(23)18(24-19-21-13-14-22(19)20)12-11-16-8-3-2-4-9-16/h2-10,18,23H,11-14H2,1H3
InChIKey
IFYUTDVZJFCGRF-UHFFFAOYSA-N
Compound name
3-(2-methylphenyl)-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

338.1453 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.15258 180.1
[M+Na]+ 361.13452 189.0
[M-H]- 337.13802 187.5
[M+NH4]+ 356.17912 197.8
[M+K]+ 377.10846 182.7
[M+H-H2O]+ 321.14256 172.6
[M+HCOO]- 383.14350 194.2
[M+CH3COO]- 397.15915 190.7
[M+Na-2H]- 359.11997 178.8
[M]+ 338.14475 181.4
[M]- 338.14585 181.4
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.