| SpectraBase Spectrum ID |
HRcBVm3kuSc |
| Name |
3,17-Dimethoxy-21A-homo-19-nor-17A-pregna-1,3,5(10)-trien-20-yne |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.224580204 u |
| Formula |
C23H30O2 |
| InChI |
InChI=1S/C23H30O2/c1-5-12-23(25-4)14-11-21-20-8-6-16-15-17(24-3)7-9-18(16)19(20)10-13-22(21,23)2/h7,9,15,19-21H,6,8,10-11,13-14H2,1-4H3/t19-,20-,21+,22+,23+/m1/s1 |
| InChIKey |
JRLJOJHGVMODEF-VROINQGHSA-N |
| Molecular Weight |
338.491 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CCC4=C([C@]3(CC2)[H])C=CC(OC)=C4)[H])(CC[C@]1(C#CC)OC)[H])C |
