| SpectraBase Spectrum ID |
7981gZXxbjP |
| Name |
5-((5R,5aS,8R,9aR)-5,8-Dimethyloctahydrobenzo[d][1,3]dioxepin-2-yl)-2-methoxyphenol |
| Classification |
Methoxyphenols |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
306.183109313 u |
| Formula |
C18H26O4 |
| InChI |
InChI=1S/C18H26O4/c1-11-4-6-14-12(2)10-21-18(22-17(14)8-11)13-5-7-16(20-3)15(19)9-13/h5,7,9,11-12,14,17-19H,4,6,8,10H2,1-3H3/t11-,12+,14+,17-,18?/m1/s1 |
| InChIKey |
RGOJGXILLLHHRA-ZQFUBGSXSA-N |
| Molecular Weight |
306.402 g/mol |
| Number of Peaks |
23 |
| SMILES |
Oc1c(ccc(c1)C1OC[C@@]([C@]2([C@](O1)(C[C@@](CC2)(C)[H])[H])[H])(C)[H])OC |
| SPLASH |
splash10-0udi-2913000000-2cf2478eb52910d6f36e |
| Source of Spectrum |
FF-29-125-10a (DOI: 10.1002/ffj.3187) |
| Wiley ID |
1775693 |
![5-((5R,5aS,8R,9aR)-5,8-Dimethyloctahydrobenzo[d][1,3]dioxepin-2-yl)-2-methoxyphenol](/api/spectrum/7981gZXxbjP/structure.png?h=300&w=458 "5-((5R,5aS,8R,9aR)-5,8-Dimethyloctahydrobenzo[d][1,3]dioxepin-2-yl)-2-methoxyphenol")
