| SpectraBase Compound ID | 8iMOQPtcmfc |
|---|---|
| InChI | InChI=1S/C21H18O7/c22-17-12-11-16(28-20(25)15-9-5-2-6-10-15)18(23)21(17,26)13-27-19(24)14-7-3-1-4-8-14/h1-12,16,18,23,26H,13H2/t16-,18-,21-/m0/s1 |
| InChIKey | UUNZIGRBVXAOSR-MDKPJZGXSA-N |
| Mol Weight | 382.37 g/mol |
| Molecular Formula | C21H18O7 |
| Exact Mass | 382.105253 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4UVgXKENjE |
|---|---|
| Name | Tonkinenin A |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H18O7 |
| InChI | InChI=1S/C21H18O7/c22-17-12-11-16(28-20(25)15-9-5-2-6-10-15)18(23)21(17,26)13-27-19(24)14-7-3-1-4-8-14/h1-12,16,18,23,26H,13H2/t16-,18-,21-/m0/s1 |
| InChIKey | UUNZIGRBVXAOSR-MDKPJZGXSA-N |
| Molecular Weight | 382.368 g/mol |
| SMILES | O[C@@]1([C@@](C(C=C[C@@]1(OC(=O)c1ccccc1)[H])=O)(COC(=O)c1ccccc1)O)[H] |
| SPLASH | splash10-0aw9-0937000000-260b32142c8941662fbc |
| Source of Spectrum | F-52-12378-1 |
| Wiley ID | 798975 |