| SpectraBase Spectrum ID |
Dtel1iQn6gY |
| Name |
4-((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(22-16(14)8-11)13-5-7-15(19)17(9-13)20-3/h5,7,9,11-12,14,16,18-19H,4,6,8,10H2,1-3H3/t11-,12+,14+,16-,18?/m1/s1 |
| InChIKey |
NYYPTIGTXRRKOY-UHLRMOPESA-N |
| Molecular Weight |
306.402 g/mol |
| Number of Peaks |
22 |
| SMILES |
Oc1c(cc(cc1)C1OC[C@@]([C@]2([C@](O1)(C[C@@](CC2)(C)[H])[H])[H])(C)[H])OC |
| SPLASH |
splash10-0udi-5901000000-58d9f4154f3805ae831b |
| Source of Spectrum |
FF-29-125-9a (DOI: 10.1002/ffj.3187) |
| Wiley ID |
1775708 |
![4-((5R,5aS,8R,9aR)-5,8-dimethyloctahydrobenzo[d][1,3]dioxepin-2-yl)-2-methoxyphenol](/api/spectrum/Dtel1iQn6gY/structure.png?h=300&w=458 "4-((5R,5aS,8R,9aR)-5,8-dimethyloctahydrobenzo[d][1,3]dioxepin-2-yl)-2-methoxyphenol")
