| SpectraBase Compound ID | LSqNRprZuUV |
|---|---|
| InChI | InChI=1S/C29H50O3/c1-19(2)10-9-11-20(3)23-12-13-24-22-18-26(32-21(4)30)29(31)16-8-7-15-28(29,6)25(22)14-17-27(23,24)5/h19-20,22-26,31H,7-18H2,1-6H3/t20-,22+,23-,24+,25+,26-,27-,28-,29-/m1/s1 |
| InChIKey | MMJJMEZNUVBJTN-PARQNSHSSA-N |
| Mol Weight | 446.7 g/mol |
| Molecular Formula | C29H50O3 |
| Exact Mass | 446.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 76dreY1NvkI |
|---|---|
| Name | 5-BETA-CHOLESTANE-5,6-BETA-DIOL-6-ACETATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H50O3 |
| InChI | InChI=1S/C29H50O3/c1-19(2)10-9-11-20(3)23-12-13-24-22-18-26(32-21(4)30)29(31)16-8-7-15-28(29,6)25(22)14-17-27(23,24)5/h19-20,22-26,31H,7-18H2,1-6H3/t20-,22+,23-,24+,25+,26-,27-,28-,29-/m1/s1 |
| InChIKey | MMJJMEZNUVBJTN-PARQNSHSSA-N |
| Literature Reference Author | J.M.COXON,J.R.GIBSON |
| Literature Reference Citation | AUSTR.J.CHEM.,34,1451(1981) |
| Literature Reference DOI | 10.1071/ch9811451 |
| Molecular Weight | 446.714 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UNIW22768 |