![Androstan-17-ol, 4-[1-naphthyl]-](/api/spectrum/GYoR7vE9MXq/structure.png?h=300&w=458 "Androstan-17-ol, 4-[1-naphthyl]-")
| SpectraBase Compound ID | Au5YuGp7jti |
|---|---|
| InChI | InChI=1S/C29H38O/c1-28-17-6-11-22(21-10-5-8-19-7-3-4-9-20(19)21)24(28)13-12-23-25-14-15-27(30)29(25,2)18-16-26(23)28/h3-5,7-10,22-27,30H,6,11-18H2,1-2H3/t22?,23-,24?,25-,26-,27?,28-,29-/m0/s1 |
| InChIKey | GVMWHULNKNYUHF-ZAPQOZKOSA-N |
| Mol Weight | 402.6 g/mol |
| Molecular Formula | C29H38O |
| Exact Mass | 402.292266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GYoR7vE9MXq |
|---|---|
| Name | Androstan-17-ol, 4-[1-naphthyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 402.292265843 u |
| Formula | C29H38O |
| InChI | InChI=1S/C29H38O/c1-28-17-6-11-22(21-10-5-8-19-7-3-4-9-20(19)21)24(28)13-12-23-25-14-15-27(30)29(25,2)18-16-26(23)28/h3-5,7-10,22-27,30H,6,11-18H2,1-2H3/t22?,23-,24?,25-,26-,27?,28-,29-/m0/s1 |
| InChIKey | GVMWHULNKNYUHF-ZAPQOZKOSA-N |
| Molecular Weight | 402.622 g/mol |
| SMILES | C1CC[C@]2(C(C1C=1C=3C=CC=CC3C=CC1)CC[C@@]1([C@@]2(CC[C@]2([C@]1(CCC2O)[H])C)[H])[H])C |