| SpectraBase Spectrum ID |
A5dnsSMk6xy |
| Name |
Ketolester |
| Alternate Name(s) |
Methyl (1S,5R,9S,13S)-13-hydroxy-5,9-dimethyl-14-oxotetracyclo[11.2.1.0(1,10).0(4,9)]hexadecane-5-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H30O4 |
| InChI |
InChI=1S/C20H30O4/c1-17-7-4-8-18(2,16(22)24-3)13(17)5-9-19-11-15(21)20(23,12-19)10-6-14(17)19/h13-14,23H,4-12H2,1-3H3/t13?,14?,17-,18-,19-,20+/m1/s1 |
| InChIKey |
AQRYMJDRMLBKMD-DAPQMUNQSA-N |
| Molecular Weight |
334.456 g/mol |
| SMILES |
O[C@@]12C[C@]3(C([C@@]4(CCC[C@](C4CC3)(C(=O)OC)C)C)CC2)CC1=O |
| SPLASH |
splash10-0a4i-3961000000-45f1aaa6c1814a093293 |
| Source of Spectrum |
EP-7976-0-0 |
| Wiley ID |
1331088 |
