| SpectraBase Spectrum ID |
CJXQAHAFZvx |
| Name |
13-Ethylenedioxy-14,15-nor-ent-halima-1(10)-en-18-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.250794952 u |
| Formula |
C20H34O3 |
| InChI |
InChI=1S/C20H34O3/c1-15-7-8-16-17(6-5-9-18(16,2)14-21)19(15,3)10-11-20(4)22-12-13-23-20/h6,15-16,21H,5,7-14H2,1-4H3/t15-,16+,18-,19+/m1/s1 |
| InChIKey |
ZMZVZRFVDLKYFN-JFRXWTBNSA-N |
| Molecular Weight |
322.489 g/mol |
| SMILES |
C1=2[C@@](CCC3(OCCO3)C)([C@](C)(CC[C@@]1([C@](CO)(C)CCC2)[H])[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916394 |
