| SpectraBase Compound ID | 2togTNvJx56 |
|---|---|
| InChI | InChI=1S/C28H48O2/c1-19(2)8-7-9-20(3)23-10-11-24-22-13-17-28(30-6)18-21(29)12-16-27(28,5)25(22)14-15-26(23,24)4/h19-20,22-25H,7-18H2,1-6H3/t20-,22+,23-,24+,25+,26-,27-,28-/m1/s1 |
| InChIKey | CBSKQULHAUQJOU-FRDWVKLBSA-N |
| Mol Weight | 416.7 g/mol |
| Molecular Formula | C28H48O2 |
| Exact Mass | 416.365431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H4G4awBEszs |
|---|---|
| Name | 5-METHOXY-5-ALPHA-CHOLESTAN-3-ONE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H48O2 |
| InChI | InChI=1S/C28H48O2/c1-19(2)8-7-9-20(3)23-10-11-24-22-13-17-28(30-6)18-21(29)12-16-27(28,5)25(22)14-15-26(23,24)4/h19-20,22-25H,7-18H2,1-6H3/t20-,22+,23-,24+,25+,26-,27-,28-/m1/s1 |
| InChIKey | CBSKQULHAUQJOU-FRDWVKLBSA-N |
| Literature Reference Author | J.W.BLUNT,J.B.STOTHERS |
| Literature Reference Citation | ORG.MAGN.RES.,9,439(1977) |
| Literature Reference DOI | 10.1002/mrc.1270090802 |
| Molecular Weight | 416.688 g/mol |
| Solvent | CHCl3 |
| Source File Reference | UNIW4041 |