| SpectraBase Spectrum ID |
4rVOdoXy0CN |
| Name |
4-Isothiocyanatophenyl 4-pentylbicyclo[2.2.2]octane-1-carboxylate |
| Source of Sample |
Sigma-Aldrich Co. LLC. |
| Catalog Number |
370053 |
| CAS Registry Number |
121235-90-3 |
| Copyright |
Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H27NO2S |
| InChI |
InChI=1S/C21H27NO2S/c1-2-3-4-9-20-10-13-21(14-11-20,15-12-20)19(23)24-18-7-5-17(6-8-18)22-16-25/h5-8H,2-4,9-15H2,1H3 |
| InChIKey |
BXZVNXOHCXCVAG-UHFFFAOYSA-N |
| Observed nucleus |
13C |
| Purity |
99% |
| Solvent |
CDCl3 |
| Source of Spectrum |
Sigma-Aldrich Co. LLC. |
| Wiley ID |
SIAL_13CNMR_007917 |
![4-Isothiocyanatophenyl 4-pentylbicyclo[2.2.2]octane-1-carboxylate](/api/spectrum/4rVOdoXy0CN/structure.png?h=300&w=458 "4-Isothiocyanatophenyl 4-pentylbicyclo[2.2.2]octane-1-carboxylate")
