| SpectraBase Spectrum ID |
5b0Myn0bscM |
| Name |
(3S,3aR,8aR,9aS)-4-Bromo-3-methyl-3a,5,6,7,8,8a,9,9a-octahydro-3H-naphtho[2,3-c]furan-1-one |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.041192785 u |
| Formula |
C13H17BrO2 |
| InChI |
InChI=1S/C13H17BrO2/c1-7-11-10(13(15)16-7)6-8-4-2-3-5-9(8)12(11)14/h7-8,10-11H,2-6H2,1H3/t7-,8+,10-,11-/m0/s1 |
| InChIKey |
XUAQESPZZVOQEY-OEIWMXHLSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0004.403 |
| Optical Rotation |
[a]D20 = +16.1 (c = 1.320, CHCl3) |
| Quality |
79 |
| SMILES |
C1(Br)=C2[C@@](C[C@]3([C@@]1([C@@](OC3=O)(C)[H])[H])[H])(CCCC2)[H] |
| SPLASH |
splash10-01ox-9460000000-9977c8868722d50e26a0 |
| Source of Spectrum |
ARK-2003-36-25a (DOI: 10.3998/ark.5550190.0004.403) |
| Thin-Layer Chromatography |
0.38 (isooctane/EtOAc, 4:1) |
| Wiley ID |
1899919 |
![(3S,3aR,8aR,9aS)-4-Bromo-3-methyl-3a,5,6,7,8,8a,9,9a-octahydro-3H-naphtho[2,3-c]furan-1-one](/api/spectrum/5b0Myn0bscM/structure.png?h=300&w=458 "(3S,3aR,8aR,9aS)-4-Bromo-3-methyl-3a,5,6,7,8,8a,9,9a-octahydro-3H-naphtho[2,3-c]furan-1-one")
