| SpectraBase Compound ID | GszgyahW2Tl |
|---|---|
| InChI | InChI=1S/C21H36O2/c1-20-11-9-15(22-3)13-14(20)5-6-16-17-7-8-19(23-4)21(17,2)12-10-18(16)20/h14-19H,5-13H2,1-4H3 |
| InChIKey | AQOCBVOXXCEOLR-UHFFFAOYSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C21H36O2 |
| Exact Mass | 320.27153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7SfTgNWex6D |
|---|---|
| Name | 5.alpha.-Androstane-3.beta.,17.beta.-diol, dimethyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 320.271530397 u |
| Formula | C21H36O2 |
| InChI | InChI=1S/C21H36O2/c1-20-11-9-15(22-3)13-14(20)5-6-16-17-7-8-19(23-4)21(17,2)12-10-18(16)20/h14-19H,5-13H2,1-4H3 |
| InChIKey | AQOCBVOXXCEOLR-UHFFFAOYSA-N |
| Molecular Weight | 320.517 g/mol |
| SMILES | C12C3(C(CC(CC3)OC)CCC1C1CCC(C1(CC2)C)OC)C |