| SpectraBase Compound ID | EfN7TmqqA2F |
|---|---|
| InChI | InChI=1S/C17H22O4/c1-9-5-6-14-12(9)7-13-10(2)16(19)20-15(13)8-17(14,4)21-11(3)18/h5,12,14-15H,6-8H2,1-4H3/t12-,14+,15-,17+/m0/s1 |
| InChIKey | SNRYBWSIEHPBRX-PWXKEOIMSA-N |
| Mol Weight | 290.36 g/mol |
| Molecular Formula | C17H22O4 |
| Exact Mass | 290.151809 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FThLKH1zs8A |
|---|---|
| Name | 10.alpha.-Acetoxy-1,5.alpha.H,8.beta.H-guaia-3,7(11)-dien-8,12-olide |
| Alternate Name(s) | Acetic acid [(3aS,5R,5aR,8aR)-1,5,8-trimethyl-2-oxo-3a,4,5a,6,8a,9-hexahydroazuleno[6,7-b]furan-5-yl] ester [(3aS,5R,5aR,8aR)-1,5,8-trimethyl-2-oxo-3a,4,5a,6,8a,9-hexahydroazuleno[6,7-b]furan-5-yl] acetate [(3aS,5R,5aR,8aR)-1,5,8-trimethyl-2-oxidanylidene-3a,4,5a,6,8a,9-hexahydroazuleno[6,7-b]furan-5-yl] ethanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H22O4 |
| InChI | InChI=1S/C17H22O4/c1-9-5-6-14-12(9)7-13-10(2)16(19)20-15(13)8-17(14,4)21-11(3)18/h5,12,14-15H,6-8H2,1-4H3/t12-,14+,15-,17+/m0/s1 |
| InChIKey | SNRYBWSIEHPBRX-PWXKEOIMSA-N |
| Molecular Weight | 290.359 g/mol |
| SMILES | C12=C(C(=O)O[C@]2(C[C@](OC(=O)C)(C)[C@]2([C@@](C1)(C(=CC2)C)[H])[H])[H])C |
| SPLASH | splash10-001i-0090000000-526cfdf9e6e658a23703 |
| Source of Spectrum | J-65-6706-10 |
| Wiley ID | 1533490 |