| SpectraBase Spectrum ID |
IR5SYa287ed |
| Name |
17-Oxa-5.alpha.,13.alpha.-androstan-16-one |
| Alternate Name(s) |
(3aS,3bR,5aR,9aS,9bS,11aR)-9a,11a-dimethyltetradecahydrophenanthro[2,1-b]furan-2(3H)-one |
| CAS Registry Number |
83679-51-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H28O2 |
| InChI |
InChI=1S/C18H28O2/c1-17-9-4-3-5-12(17)6-7-13-14(17)8-10-18(2)15(13)11-16(19)20-18/h12-15H,3-11H2,1-2H3/t12-,13-,14+,15+,17+,18-/m1/s1 |
| InChIKey |
OOGFPQSMIRIYKL-NREAYSRSSA-N |
| Molecular Weight |
276.420 g/mol |
| SMILES |
[C@]12([C@]([C@@]3(CC[C@@]4([C@]([C@]3(CC2)[H])(C)CCCC4)[H])[H])(CC(O1)=O)[H])C |
| SPLASH |
splash10-03di-0090000000-ddf699ccf1db3dd89adb |
| Source of Spectrum |
J-49-3759-0 |
| Wiley ID |
1280476 |
