| SpectraBase Spectrum ID |
AA5veWV8ezS |
| Name |
2.beta.,19-Oxido-3.alpha.-hydroxy-5.alpha.H-pregnan-20-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.235144887 u |
| Formula |
C21H32O3 |
| InChI |
InChI=1S/C21H32O3/c1-12(22)15-5-6-16-14-4-3-13-9-18(23)19-10-21(13,11-24-19)17(14)7-8-20(15,16)2/h13-19,23H,3-11H2,1-2H3/t13-,14-,15+,16-,17-,18-,19-,20+,21+/m0/s1 |
| InChIKey |
NSYIZFAQBBPTMG-QCXIBVAZSA-N |
| Instrument Name |
Shimadzu QP-5000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0004.a43 |
| Molecular Weight |
332.484 g/mol |
| Quality |
219 |
| SMILES |
O[C@]1(C[C@]2([C@]3(C[C@@]1(OC3)[H])[C@@]1([C@@](CC2)([C@]2([C@](CC1)([C@](CC2)(C(C)=O)[H])C)[H])[H])[H])[H])[H] |
| SPLASH |
splash10-0006-9001000000-bf45594c636b497ed415 |
| Source of Spectrum |
ARK-2003-474-5 (DOI: 10.3998/ark.5550190.0004.a43) |
| Wiley ID |
1899718 |
