| SpectraBase Spectrum ID |
JLVRcpqLPJH |
| Name |
5,17.beta.-Dihydroxy-4-nor-5.alpha.-androstan-2-ONE17-acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.214409442 u |
| Formula |
C20H30O4 |
| InChI |
InChI=1S/C20H30O4/c1-12(21)24-17-5-4-15-14-6-9-20(23)11-13(22)10-19(20,3)16(14)7-8-18(15,17)2/h14-17,23H,4-11H2,1-3H3/t14-,15-,16-,17?,18-,19+,20+/m0/s1 |
| InChIKey |
HVEKHSHVRVSXRD-JSJPWGIMSA-N |
| Molecular Weight |
334.456 g/mol |
| SMILES |
[C@@]12([C@](CC(C2)=O)(CC[C@]2([C@@]3(CCC([C@]3(CC[C@]12[H])C)OC(=O)C)[H])[H])O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925606 |
