| SpectraBase Spectrum ID |
IG7WeRui9Y4 |
| Name |
(5S,6R)-5-[(2,5-dimethoxyphenyl)methyl]-5,6-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-ol |
| Appearance |
Pale yellow oil |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30O3 |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C21H30O3/c1-14-8-10-17-18(6-5-7-19(17)22)21(14,2)13-15-12-16(23-3)9-11-20(15)24-4/h9,11-12,14,19,22H,5-8,10,13H2,1-4H3/t14-,19?,21+/m1/s1 |
| InChIKey |
OAEXMVZRYATUAM-NUOIPDLJSA-N |
| Instrument Name |
Agilent HP6890- 5937 N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202105733 |
| Molecular Weight |
330.468 g/mol |
| Optical Rotation |
[a]D20 = +0.3 (436 nm), +0.7 (546 nm), +0.4 (579 nm), +0.1 (589 nm) (c = 0.50, CHCl3) |
| SMILES |
OC1C2=C(CCC1)[C@]([C@@](CC2)(C)[H])(Cc1cc(ccc1OC)OC)C |
| SPLASH |
splash10-0iki-1900000000-8bb7949b69ee1b8f10ee |
| Sample Comments |
dr = 4:3 |
| Source of Spectrum |
ACI-60-SM31-25 |
| Thin-Layer Chromatography |
Rf = 0.61 (c-Hex/EtOAc, 1:1) |
| Wiley ID |
1882568 |
![(5S,6R)-5-[(2,5-dimethoxyphenyl)methyl]-5,6-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-ol](/api/spectrum/IG7WeRui9Y4/structure.png?h=300&w=458 "(5S,6R)-5-[(2,5-dimethoxyphenyl)methyl]-5,6-dimethyl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-ol")
