| SpectraBase Compound ID | 3Xz0LFK8FjH |
|---|---|
| InChI | InChI=1S/C20H30O2/c1-13(2)19-16-10-9-14(3)7-6-8-15(4)11-18(22)20(16,5)12-17(19)21/h7,11,13,16,19H,6,8-10,12H2,1-5H3/b14-7-,15-11-/t16-,19-,20-/m1/s1 |
| InChIKey | KPAMHMMBEADFDP-PTVTUDBTSA-N |
| Mol Weight | 302.46 g/mol |
| Molecular Formula | C20H30O2 |
| Exact Mass | 302.22458 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FCLVUJ9sabV |
|---|---|
| Name | Edudione |
| Alternate Name(s) | (1R,3aR,5Z,9Z,12aR)-1-isopropyl-3a,6,10-trimethyl-3,7,8,11,12,12a-hexahydro-1H-cyclopenta[11]annulene-2,4-dione (1R,3aR,5Z,9Z,12aR)-3a,6,10-trimethyl-1-propan-2-yl-3,7,8,11,12,12a-hexahydro-1H-cyclopenta[11]annulene-2,4-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H30O2 |
| InChI | InChI=1S/C20H30O2/c1-13(2)19-16-10-9-14(3)7-6-8-15(4)11-18(22)20(16,5)12-17(19)21/h7,11,13,16,19H,6,8-10,12H2,1-5H3/b14-7-,15-11-/t16-,19-,20-/m1/s1 |
| InChIKey | KPAMHMMBEADFDP-PTVTUDBTSA-N |
| Molecular Weight | 302.458 g/mol |
| SMILES | [C@]12([C@@]([C@@](C(C)C)(C(C2)=O)[H])(CC\C(=C/CC\C(=C/C1=O)C)C)[H])C |
| SPLASH | splash10-0aw9-9440000000-054982c4c01b9b624d04 |
| Source of Spectrum | X2-58-231-5 |
| Wiley ID | 1605782 |