| SpectraBase Spectrum ID |
34x31Wu5LOP |
| Name |
5.alpha.-Androstan-3-one, 17.beta.-hydroxy-4.alpha.-methyl-, cyclic ethylene acetal |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.266445016 u |
| Formula |
C22H36O3 |
| InChI |
InChI=1S/C22H36O3/c1-14-16-5-4-15-17-6-7-19(23)21(17,3)9-8-18(15)20(16,2)10-11-22(14)24-12-13-25-22/h14-19,23H,4-13H2,1-3H3 |
| InChIKey |
OWMMPQHLIUCKEV-UHFFFAOYSA-N |
| Molecular Weight |
348.527 g/mol |
| SMILES |
C12(C)C3C(C4C(CC3)(C)C(O)CC4)CCC2C(C)C2(CC1)OCCO2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878366 |
