| SpectraBase Spectrum ID |
BFfalaPSmT1 |
| Name |
(1S*,4R*,7R*,8R*)-5,8-Bis(hydroxymethyl)-1,7-dimethylbicyclo[2.2.2]oct-5-en-2-one |
| Alternate Name(s) |
(1S,4R,7R,8R)-5,8-bis(hydroxymethyl)-1,7-dimethylbicyclo[2.2.2]oct-5-en-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18O3 |
| InChI |
InChI=1S/C12H18O3/c1-7-10(6-14)9-3-11(15)12(7,2)4-8(9)5-13/h4,7,9-10,13-14H,3,5-6H2,1-2H3/t7-,9-,10-,12-/m1/s1 |
| InChIKey |
SMMQJQUOEVFOQE-UGKPPGOTSA-N |
| Literature Reference DOI |
10.1021/ol702062p |
| Molecular Weight |
210.273 g/mol |
| SMILES |
OCC1=C[C@@]2([C@@]([C@@](CO)([C@@]1(CC2=O)[H])[H])(C)[H])C |
| SPLASH |
splash10-0a59-1900000000-20de0a18cec40bbef8c6 |
| Source of Spectrum |
A1-9-4563/SMS4-10 |
| Wiley ID |
1758715 |
![(1S*,4R*,7R*,8R*)-5,8-Bis(hydroxymethyl)-1,7-dimethylbicyclo[2.2.2]oct-5-en-2-one](/api/spectrum/BFfalaPSmT1/structure.png?h=300&w=458 "(1S*,4R*,7R*,8R*)-5,8-Bis(hydroxymethyl)-1,7-dimethylbicyclo[2.2.2]oct-5-en-2-one")
