| SpectraBase Spectrum ID |
frjed5wPst |
| Name |
1.alpha.-trans-2.alpha.,6.beta.-dimethylbicyclo[4.4.0]decane-3,7-dione |
| Alternate Name(s) |
(4aS,5S,8aS)-5,8a-dimethylhexahydro-1,6(2H,5H)-naphthalenedione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18O2 |
| InChI |
InChI=1S/C12H18O2/c1-8-9-4-3-5-11(14)12(9,2)7-6-10(8)13/h8-9H,3-7H2,1-2H3/t8-,9-,12-/m0/s1 |
| InChIKey |
BAPYGQXRXLEUKO-AUTRQRHGSA-N |
| Molecular Weight |
194.274 g/mol |
| SMILES |
[C@@]12([C@]([C@](C)(C(CC2)=O)[H])(CCCC1=O)[H])C |
| SPLASH |
splash10-004l-0900000000-5cc9fb8491f54f6f6eaf |
| Source of Spectrum |
C-99-1956-0 |
| Wiley ID |
1191024 |
![1.alpha.-trans-2.alpha.,6.beta.-dimethylbicyclo[4.4.0]decane-3,7-dione](/api/spectrum/frjed5wPst/structure.png?h=300&w=458 "1.alpha.-trans-2.alpha.,6.beta.-dimethylbicyclo[4.4.0]decane-3,7-dione")
