| SpectraBase Spectrum ID |
z9JUfWTVKH |
| Name |
1-Hexyl-4-(4-isothiocyanatophenyl)bicyclo[2.2.2]octane |
| Source of Sample |
Sigma-Aldrich Co. LLC. |
| Catalog Number |
369543 |
| CAS Registry Number |
121219-38-3 |
| Copyright |
Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H29NS |
| InChI |
InChI=1S/C21H29NS/c1-2-3-4-5-10-20-11-14-21(15-12-20,16-13-20)18-6-8-19(9-7-18)22-17-23/h6-9H,2-5,10-16H2,1H3 |
| InChIKey |
QFAIJDOQNIKXJY-UHFFFAOYSA-N |
| Observed nucleus |
13C |
| Purity |
98% |
| Solvent |
CDCl3 |
| Source of Spectrum |
Sigma-Aldrich Co. LLC. |
| Synonyms |
AC1MSFN2
SCHEMBL4524092
CTK4B2248
ZINC2558661 |
| Wiley ID |
SIAL_13CNMR_007901 |
![1-Hexyl-4-(4-isothiocyanatophenyl)bicyclo[2.2.2]octane](/api/spectrum/z9JUfWTVKH/structure.png?h=300&w=458 "1-Hexyl-4-(4-isothiocyanatophenyl)bicyclo[2.2.2]octane")
