| SpectraBase Compound ID | KBdu8lkrfkQ |
|---|---|
| InChI | InChI=1S/C22H32O6/c1-13-7-18(25)20-21(3,12-28-14(2)23)9-16(24)10-22(20,4)17(13)6-5-15-8-19(26)27-11-15/h8,16,18,20,24-25H,5-7,9-12H2,1-4H3/t16-,18-,20-,21+,22+/m0/s1 |
| InChIKey | HPUOCKVDJFCKTR-WROXGLCASA-N |
| Mol Weight | 392.5 g/mol |
| Molecular Formula | C22H32O6 |
| Exact Mass | 392.219889 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | D6gXeHn1y9i |
|---|---|
| Name | Amoenolide A - 19-acetate |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H32O6 |
| InChI | InChI=1S/C22H32O6/c1-13-7-18(25)20-21(3,12-28-14(2)23)9-16(24)10-22(20,4)17(13)6-5-15-8-19(26)27-11-15/h8,16,18,20,24-25H,5-7,9-12H2,1-4H3/t16-,18-,20-,21+,22+/m0/s1 |
| InChIKey | HPUOCKVDJFCKTR-WROXGLCASA-N |
| Molecular Weight | 392.492 g/mol |
| SMILES | O[C@@]1(C[C@]2([C@@]([C@](CC(=C2CCC2=CC(=O)OC2)C)(O)[H])([C@](C1)(COC(=O)C)C)[H])C)[H] |
| SPLASH | splash10-0006-9000000000-b7973a6e19d34c4ac5a4 |
| Source of Spectrum | X2-57-773-2 |
| Wiley ID | 1605424 |