CID 3070345

86346-87-4

Structural Information

Molecular Formula
C20H22N2O2S
SMILES
COC1=CC=CC=C1C2(C(SC3=NCCN32)CCC4=CC=CC=C4)O
InChI
InChI=1S/C20H22N2O2S/c1-24-17-10-6-5-9-16(17)20(23)18(25-19-21-13-14-22(19)20)12-11-15-7-3-2-4-8-15/h2-10,18,23H,11-14H2,1H3
InChIKey
JWRHRMFMAGMFMD-UHFFFAOYSA-N
Compound name
3-(2-methoxyphenyl)-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

354.1402 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.147476 183.2
[M+Na]+ 377.129418 191.8
[M-H]- 353.132924 190.6
[M+NH4]+ 372.174023 200.1
[M+K]+ 393.103358 186.1
[M+H-H2O]+ 337.137460 175.6
[M+HCOO]- 399.138401 197.5
[M+CH3COO]- 413.154051 193.6
[M+Na-2H]- 375.114866 182.2
[M]+ 354.13965142 185.9
[M]- 354.14074858 185.9
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.