| SpectraBase Spectrum ID |
1wv8LLtk7U |
| Name |
(6aR,10aR)-3-[1-(4-Bromobutyl)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 |
C24H33BrO3 |
| InChI |
InChI=1S/C24H33BrO3/c1-23(2)19-8-7-17(26)15-18(19)22-20(27)13-16(14-21(22)28-23)24(9-3-4-10-24)11-5-6-12-25/h13-14,18-19,27H,3-12,15H2,1-2H3/t18-,19-/m1/s1 |
| InChIKey |
TVUHEVJRJRCHSF-RTBURBONSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm100641g |
| Molecular Weight |
449.429 g/mol |
| SMILES |
Oc1cc(cc2OC([C@]3([C@@](CC(CC3)=O)(c12)[H])[H])(C)C)C1(CCCCBr)CCCC1 |
| SPLASH |
splash10-02t9-3369200000-8033a02050a0cce33a8e |
| Source of Spectrum |
AF-53-7006-15a |
| Wiley ID |
1846286 |
![(6aR,10aR)-3-[1-(4-Bromobutyl)cyclopentyl]-6,6a,7,8,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-9H-dibenzo[b,d]pyran-9-one](/api/spectrum/1wv8LLtk7U/structure.png?h=300&w=458 "(6aR,10aR)-3-[1-(4-Bromobutyl)cyclopentyl]-6,6a,7,8,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-9H-dibenzo[b,d]pyran-9-one")
