CID 3070321

86346-67-0

Structural Information

Molecular Formula
C19H20N2OS
SMILES
C1CN2C(=N1)SC(C2(C3=CC=CC=C3)O)CCC4=CC=CC=C4
InChI
InChI=1S/C19H20N2OS/c22-19(16-9-5-2-6-10-16)17(23-18-20-13-14-21(18)19)12-11-15-7-3-1-4-8-15/h1-10,17,22H,11-14H2
InChIKey
NUXNCRDIOVCUOV-UHFFFAOYSA-N
Compound name
3-phenyl-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

2
Patents

324.12964 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.13692 175.6
[M+Na]+ 347.11886 184.1
[M-H]- 323.12236 182.9
[M+NH4]+ 342.16346 193.6
[M+K]+ 363.09280 178.1
[M+H-H2O]+ 307.12690 168.0
[M+HCOO]- 369.12784 190.2
[M+CH3COO]- 383.14349 186.4
[M+Na-2H]- 345.10431 175.4
[M]+ 324.12909 176.2
[M]- 324.13019 176.2
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

patents stripe