| SpectraBase Compound ID | LpLqhceuSg0 |
|---|---|
| InChI | InChI=1S/C23H32O3/c1-14(26-15(2)24)19-7-8-20-18-6-5-16-13-17(25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,14,18,20-21H,6,8-13H2,1-4H3/t14?,18-,20-,21-,22-,23+/m0/s1 |
| InChIKey | OGYWHEZXIKCLSF-DKYVNLFFSA-N |
| Mol Weight | 356.5 g/mol |
| Molecular Formula | C23H32O3 |
| Exact Mass | 356.235145 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8JpOD7m3EAP |
|---|---|
| Name | 5,16-Pregnadiene, 20-acetoxy-3-oxo |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 356.235144887 u |
| Formula | C23H32O3 |
| InChI | InChI=1S/C23H32O3/c1-14(26-15(2)24)19-7-8-20-18-6-5-16-13-17(25)9-11-22(16,3)21(18)10-12-23(19,20)4/h5,7,14,18,20-21H,6,8-13H2,1-4H3/t14?,18-,20-,21-,22-,23+/m0/s1 |
| InChIKey | OGYWHEZXIKCLSF-DKYVNLFFSA-N |
| Molecular Weight | 356.506 g/mol |
| SMILES | C1(CC[C@]2(C(C1)=CC[C@@]1([C@@]2(CC[C@]2([C@]1(CC=C2C(C)OC(C)=O)[H])C)[H])[H])C)=O |