| SpectraBase Spectrum ID |
9cP6N4Ok5Gs |
| Name |
Butyl 2-[(6aR,10aS)-1-Hydroxy-6,6-dimethyl-9-oxo6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-3-yl]-2-methylpropanoate |
| Appearance |
White foam |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H32O5 |
| InChI |
InChI=1S/C23H32O5/c1-6-7-10-27-21(26)22(2,3)14-11-18(25)20-16-13-15(24)8-9-17(16)23(4,5)28-19(20)12-14/h11-12,16-17,25H,6-10,13H2,1-5H3/t16-,17-/m1/s1 |
| InChIKey |
UALKIYOTOGCAGG-IAGOWNOFSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jmedchem.6b00717 |
| Molecular Weight |
388.504 g/mol |
| SMILES |
Oc1cc(cc2c1[C@]1([C@@](CCC(C1)=O)(C(O2)(C)C)[H])[H])C(C(OCCCC)=O)(C)C |
| SPLASH |
splash10-002s-0495000000-285c2aa809d0ba35973e |
| Source of Spectrum |
AF-59-6914-16 |
| Wiley ID |
1848860 |
![Butyl 2-[(6aR,10aS)-1-Hydroxy-6,6-dimethyl-9-oxo6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-3-yl]-2-methylpropanoate](/api/spectrum/9cP6N4Ok5Gs/structure.png?h=300&w=458 "Butyl 2-[(6aR,10aS)-1-Hydroxy-6,6-dimethyl-9-oxo6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-3-yl]-2-methylpropanoate")
