| SpectraBase Spectrum ID |
5HvWxosSptk |
| Name |
17-oxa-5.alpha.-Androstan-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
276.208930140 u |
| Formula |
C18H28O2 |
| InChI |
InChI=1S/C18H28O2/c1-17-8-5-13(19)11-12(17)3-4-14-15(17)6-9-18(2)16(14)7-10-20-18/h12,14-16H,3-11H2,1-2H3/t12-,14+,15-,16-,17-,18-/m0/s1 |
| InChIKey |
URQXFSXJCPWHIX-PZAYZMLXSA-N |
| Molecular Weight |
276.420 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CCO[C@]4(CC3)C)[H])([H])CC[C@]2(CC(CC1)=O)[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939963 |
