| SpectraBase Spectrum ID |
3Zmnu6NkSSQ |
| Name |
3,3-Ethylenedioxy-17-methoxy-D-homo-18-norandrosta-5,8,13,15,17-pentaene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.188194694 u |
| Formula |
C22H26O3 |
| InChI |
InChI=1S/C22H26O3/c1-21-9-10-22(24-11-12-25-22)14-16(21)4-6-19-18-7-5-17(23-2)13-15(18)3-8-20(19)21/h4-5,7,13H,3,6,8-12,14H2,1-2H3 |
| InChIKey |
LSZUCVZKSWBUGP-UHFFFAOYSA-N |
| Molecular Weight |
338.447 g/mol |
| SMILES |
C1C2(CC=3C(C1)(C1=C(C4=C(C=C(OC)C=C4)CC1)CC3)C)OCCO2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854096 |
