| SpectraBase Spectrum ID |
5wRyEabAadB |
| Name |
(6aR,10aR)-3-[1-(5-Bromopentyl)cyclopentyl]-6,6a,7,8,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-9H-dibenzo[b,d]pyran-9-one |
| Appearance |
White foam |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H35BrO3 |
| InChI |
InChI=1S/C25H35BrO3/c1-24(2)20-9-8-18(27)16-19(20)23-21(28)14-17(15-22(23)29-24)25(11-5-6-12-25)10-4-3-7-13-26/h14-15,19-20,28H,3-13,16H2,1-2H3/t19-,20-/m1/s1 |
| InChIKey |
MQEHHGPBZZSHMP-WOJBJXKFSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm100641g |
| Molecular Weight |
463.456 g/mol |
| SMILES |
Oc1cc(cc2OC([C@]3([C@@](CC(CC3)=O)(c12)[H])[H])(C)C)C1(CCCCCBr)CCCC1 |
| SPLASH |
splash10-03di-3139100000-bbc435256147552b25f1 |
| Source of Spectrum |
AF-53-7007-15b |
| Wiley ID |
1846287 |
![(6aR,10aR)-3-[1-(5-Bromopentyl)cyclopentyl]-6,6a,7,8,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-9H-dibenzo[b,d]pyran-9-one](/api/spectrum/5wRyEabAadB/structure.png?h=300&w=458 "(6aR,10aR)-3-[1-(5-Bromopentyl)cyclopentyl]-6,6a,7,8,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-9H-dibenzo[b,d]pyran-9-one")
