2-(benzylthio)-3-(2-oxo-1-(((1S,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)ethyl)benzo[d]thiazol-3-ium chloride
Compound with spectra: 1 MS (GC)
![2-(benzylthio)-3-(2-oxo-1-(((1S,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)ethyl)benzo[d]thiazol-3-ium chloride](/api/compound/G2f7mYeVqWk.png?ph=true&h=300&w=458 "2-(benzylthio)-3-(2-oxo-1-(((1S,2R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)ethyl)benzo[d]thiazol-3-ium chloride")
| SpectraBase Compound ID | G2f7mYeVqWk |
|---|---|
| InChI | InChI=1S/C26H30NO2S2.ClH/c1-25(2)19-13-14-26(25,3)22(15-19)29-23(16-28)27-20-11-7-8-12-21(20)31-24(27)30-17-18-9-5-4-6-10-18;/h4-12,16,19,22-23H,13-15,17H2,1-3H3;1H/q+1;/p-1/t19-,22-,23?,26-;/m1./s1 |
| InChIKey | XDMMJCHYVISXRK-LXSMASICSA-M |
| Mol Weight | 488.1 g/mol |
| Molecular Formula | C26H30ClNO2S2 |
| Exact Mass | 487.140649 g/mol |
| Parent InChIKey | MHROLPDRPBQMRT-DDQWDELTSA-M |
| Enantiomer InChIKey | XDMMJCHYVISXRK-XTUVVQPBSA-M |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | Avtar Singh, et al. Tetrahedron: Asymmetry, 10.1016/j.tetasy.2017.02.008 |