| SpectraBase Compound ID | CJDT1pMFzWm |
|---|---|
| InChI | InChI=1S/C20H32O5/c1-11(2)14-7-6-12(3)8-13(21)9-19(4,24)16-15(22)10-20(5,25)17(16)18(14)23/h8,11,14-17,22,24-25H,6-7,9-10H2,1-5H3/b12-8-/t14-,15?,16-,17-,19+,20-/m0/s1 |
| InChIKey | NVOWAVFZSKWQPR-BXTJZWFSSA-N |
| Mol Weight | 352.5 g/mol |
| Molecular Formula | C20H32O5 |
| Exact Mass | 352.224974 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4LTS4NKWG4p |
|---|---|
| Name | 4,6,8-Trihydroxy-11-capnosene-2,10-dione |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H32O5 |
| InChI | InChI=1S/C20H32O5/c1-11(2)14-7-6-12(3)8-13(21)9-19(4,24)16-15(22)10-20(5,25)17(16)18(14)23/h8,11,14-17,22,24-25H,6-7,9-10H2,1-5H3/b12-8-/t14-,15?,16-,17-,19+,20-/m0/s1 |
| InChIKey | NVOWAVFZSKWQPR-BXTJZWFSSA-N |
| Molecular Weight | 352.471 g/mol |
| SMILES | OC1[C@@]2([C@@](CC(\C=C/(CC[C@](C([C@]2([C@](C1)(O)C)[H])=O)(C(C)C)[H])C)=O)(O)C)[H] |
| SPLASH | splash10-0006-9200000000-199b749f62bbc7218906 |
| Source of Spectrum | SB-46-370-1 |
| Wiley ID | 745083 |