| SpectraBase Compound ID | ENsDsi0uAx0 |
|---|---|
| InChI | InChI=1S/C19H30O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,11-14,16-17,20-22H,3-8,10H2,1-2H3 |
| InChIKey | VDNDIJUBNPXREI-UHFFFAOYSA-N |
| Mol Weight | 306.45 g/mol |
| Molecular Formula | C19H30O3 |
| Exact Mass | 306.219495 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KsLtKKd1UGB |
|---|---|
| Name | Androst-4-ene-3,6,17-triol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.219494823 u |
| Formula | C19H30O3 |
| InChI | InChI=1S/C19H30O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,11-14,16-17,20-22H,3-8,10H2,1-2H3 |
| InChIKey | VDNDIJUBNPXREI-UHFFFAOYSA-N |
| SMILES | C1(CCC2(C(=C1)C(CC1C2CCC2(C1CCC2O)C)O)C)O |