| SpectraBase Spectrum ID |
INDyWwdEG28 |
| Name |
(Z)-5-((5aR,9aR)-6,6,9a-trimethyloctahydrobenzo[b]oxepin-3(2H)-ylidene)pentan-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H30O2 |
| InChI |
InChI=1S/C18H30O2/c1-14(19)7-5-8-15-9-10-16-17(2,3)11-6-12-18(16,4)20-13-15/h8,16H,5-7,9-13H2,1-4H3/b15-8-/t16-,18-/m1/s1 |
| InChIKey |
FXNNYLZLQPAJCF-QEZYIGEASA-N |
| Ionization Type |
EI |
| Molecular Weight |
278.436 g/mol |
| SMILES |
C[C@@]12OC\C(CC[C@@]2(C(CCC1)(C)C)[H])=C/CCC(C)=O |
| SPLASH |
splash10-0006-9400000000-cdb4856e179f8e1e83f1 |
| Source of Spectrum |
WO2021209482A1 |
| Thin-Layer Chromatography |
Rf = 0.29 (silica gel, heptane/EtOAc 3:2) |
| Wiley ID |
1880127 |
![(Z)-5-((5aR,9aR)-6,6,9a-trimethyloctahydrobenzo[b]oxepin-3(2H)-ylidene)pentan-2-one](/api/spectrum/INDyWwdEG28/structure.png?h=300&w=458 "(Z)-5-((5aR,9aR)-6,6,9a-trimethyloctahydrobenzo[b]oxepin-3(2H)-ylidene)pentan-2-one")
