| SpectraBase Compound ID | JhFn0fOKlUt |
|---|---|
| InChI | InChI=1S/C20H24O7/c1-8-4-12(21)16(24)18(3)10(8)5-13-19-7-26-20(25,17(18)19)15(23)9(2)11(19)6-14(22)27-13/h4,10-11,13,15-17,23-25H,2,5-7H2,1,3H3 |
| InChIKey | WBBVXGHSWZIJST-UHFFFAOYSA-N |
| Mol Weight | 376.41 g/mol |
| Molecular Formula | C20H24O7 |
| Exact Mass | 376.152203 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | L1bdoBNpjan |
|---|---|
| Name | Ailanthone |
| CAS Registry Number | 981-15-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H24O7 |
| InChI | InChI=1S/C20H24O7/c1-8-4-12(21)16(24)18(3)10(8)5-13-19-7-26-20(25,17(18)19)15(23)9(2)11(19)6-14(22)27-13/h4,10-11,13,15-17,23-25H,2,5-7H2,1,3H3 |
| InChIKey | WBBVXGHSWZIJST-UHFFFAOYSA-N |
| Molecular Weight | 376.405 g/mol |
| SMILES | OC12C(C(C3CC(OC4C3(C2C2(C(C4)C(=CC(C2O)=O)C)C)CO1)=O)=C)O |
| SPLASH | splash10-0fba-0932000000-9a92387f6a5bccc9ee1e |
| Source of Spectrum | D3-1980-401-13 |
| Wiley ID | 1357668 |