![3.beta.-[(Methylmercurio)methyl]-5-vinyl-A,B-bisnor-5.beta.-cholestane](/api/spectrum/KZ416GSs1wx/structure.png?h=300&w=458 "3.beta.-[(Methylmercurio)methyl]-5-vinyl-A,B-bisnor-5.beta.-cholestane")
| SpectraBase Compound ID | Blp0OoI6cIA |
|---|---|
| InChI | InChI=1S/C28H47.CH3.Hg/c1-8-28-18-22-24-13-12-23(20(4)11-9-10-19(2)3)26(24,6)16-15-25(22)27(28,7)17-14-21(28)5;;/h8,19-25H,1,5,9-18H2,2-4,6-7H3;1H3;/t20-,21+,22+,23-,24+,25+,26-,27-,28-;;/m1../s1 |
| InChIKey | MRCCXASFUPWWMB-WQRQFFEPSA-N |
| Mol Weight | 599.3 g/mol |
| Molecular Formula | C29H50Hg |
| Exact Mass | 600.361896 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KZ416GSs1wx |
|---|---|
| Name | 3-BETA-[(METHYLMERCURIO)-METHYL]-5-VINYL-A,B-BISNOR-5-BETA-CHOLESTANE |
| Compound Number | 31 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H50Hg |
| InChI | InChI=1S/C28H47.CH3.Hg/c1-8-28-18-22-24-13-12-23(20(4)11-9-10-19(2)3)26(24,6)16-15-25(22)27(28,7)17-14-21(28)5;;/h8,19-25H,1,5,9-18H2,2-4,6-7H3;1H3;/t20-,21+,22+,23-,24+,25+,26-,27-,28-;;/m1../s1 |
| InChIKey | MRCCXASFUPWWMB-WQRQFFEPSA-N |
| Literature Reference Author | P.KOCOVSKY,V.DUNN,A.GOGOLL,V.LANGER |
| Literature Reference Citation | J.ORG.CHEM.,64,101(1999) |
| Literature Reference DOI | 10.1021/jo9812882 |
| Molecular Weight | 599.306 g/mol |
| Sample ID | 39162 |
| Solvent | CDCl3 |