| SpectraBase Spectrum ID |
LxeP3DaGlnR |
| Name |
(1S*,4S*,7R*)-7-(Phenylsulfanyl)-3,3-dimethoxybicyclo[2.2.2]oct-5-en-2-one |
| Alternate Name(s) |
(1S,4S,7R)-3,3-dimethoxy-7-(phenylthio)bicyclo[2.2.2]oct-5-en-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O3S |
| InChI |
InChI=1S/C16H18O3S/c1-18-16(19-2)11-8-9-13(15(16)17)14(10-11)20-12-6-4-3-5-7-12/h3-9,11,13-14H,10H2,1-2H3/t11-,13-,14-/m1/s1 |
| InChIKey |
BHIRMBWDABDZSB-MRVWCRGKSA-N |
| Molecular Weight |
290.377 g/mol |
| SMILES |
C1(C([C@@]2([H])[C@@](C[C@]1(C=C2)[H])(Sc1ccccc1)[H])=O)(OC)OC |
| SPLASH |
splash10-0fb9-9500000000-0830ac458695d764887c |
| Source of Spectrum |
F5-4-2274-21aX |
| Wiley ID |
1732833 |
![(1S*,4S*,7R*)-7-(Phenylsulfanyl)-3,3-dimethoxybicyclo[2.2.2]oct-5-en-2-one](/api/spectrum/LxeP3DaGlnR/structure.png?h=300&w=458 "(1S*,4S*,7R*)-7-(Phenylsulfanyl)-3,3-dimethoxybicyclo[2.2.2]oct-5-en-2-one")
