| SpectraBase Compound ID | 7T470MiXgn8 |
|---|---|
| InChI | InChI=1S/C16H20O4/c1-15-6-3-7-16(2,14(18)19)12(15)5-4-10-9-20-13(17)8-11(10)15/h4,8,12H,3,5-7,9H2,1-2H3,(H,18,19)/t12-,15-,16+/m1/s1 |
| InChIKey | FIZSONPJJYYMRC-WQVCFCJDSA-N |
| Mol Weight | 276.33 g/mol |
| Molecular Formula | C16H20O4 |
| Exact Mass | 276.136159 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IKdyS8yUsOc |
|---|---|
| Name | Oidiodendronic Acid |
| Alternate Name(s) | (6aR,7S,10aS)-7,10a-dimethyl-2-oxo-4,6,6a,8,9,10-hexahydrobenzo[f][2]benzopyran-7-carboxylic acid (6aR,7S,10aS)-7,10a-dimethyl-2-oxo-4,6,6a,8,9,10-hexahydrobenzo[f]isochromene-7-carboxylic acid (6aR,7S,10aS)-7,10a-dimethyl-2-oxidanylidene-4,6,6a,8,9,10-hexahydrobenzo[f]isochromene-7-carboxylic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H20O4 |
| InChI | InChI=1S/C16H20O4/c1-15-6-3-7-16(2,14(18)19)12(15)5-4-10-9-20-13(17)8-11(10)15/h4,8,12H,3,5-7,9H2,1-2H3,(H,18,19)/t12-,15-,16+/m1/s1 |
| InChIKey | FIZSONPJJYYMRC-WQVCFCJDSA-N |
| Molecular Weight | 276.332 g/mol |
| SMILES | OC([C@@]1([C@]2([C@@](C=3C(=CC2)COC(C3)=O)(CCC1)C)[H])C)=O |
| SPLASH | splash10-0059-0090000000-dd27728681f3ede2410f |
| Source of Spectrum | E2-47-1596-7 |
| Wiley ID | 1554970 |