| SpectraBase Spectrum ID |
Bpwy5o8nXPC |
| Name |
(1R,2R,6S,9S,10S,12S,13R)-9-methyl-5,14-dimethylidene-4-oxo-3,11-dioxatetracyclo[7.5.0.0(2,6).0(10,12)]tetradecan-13-yl 3-methylbutanoate |
| Appearance |
Amorphous solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H26O5 |
| InChI |
InChI=1S/C20H26O5/c1-9(2)8-13(21)23-15-11(4)14-16-12(10(3)19(22)25-16)6-7-20(14,5)18-17(15)24-18/h9,12,14-18H,3-4,6-8H2,1-2,5H3/t12-,14-,15+,16+,17+,18+,20-/m0/s1 |
| InChIKey |
YYLXIEFRNCFYOC-JOMZGWAMSA-N |
| Instrument Name |
JOEL AX505 W |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np0603065 |
| Molecular Weight |
346.423 g/mol |
| Optical Rotation |
[a]D20 = -66.0 (c = 0.24, CHCl3) |
| Reported Formula |
C20H26O5 |
| SMILES |
[C@]12([C@]([C@@]3([C@@]([C@]4([C@@](CC3)(C(=C)C(=O)O4)[H])[H])([H])C([C@]2(OC(=O)CC(C)C)[H])=C)C)(O1)[H])[H] |
| SPLASH |
splash10-052r-9150000000-5083ff61f831f514c707 |
| Source of Spectrum |
G4-69-1570-2 |
| Wiley ID |
1873985 |
