| SpectraBase Compound ID | 5ADlzvb2I49 |
|---|---|
| InChI | InChI=1S/C15H20O5/c1-8-14-12(6-11(17-4)7-13(14)18-5)15(9(2)19-8)20-10(3)16/h6-9,15H,1-5H3/t8-,9+,15+/m0/s1 |
| InChIKey | CNKGFZJJYTZVCE-IQMYEBEASA-N |
| Mol Weight | 280.32 g/mol |
| Molecular Formula | C15H20O5 |
| Exact Mass | 280.131074 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HeuQrYqV2it |
|---|---|
| Name | rel-(1S,3R,4S)-4-Acetoxy-6,8-dimethoxy-1,3-dimethylisochromane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H20O5 |
| InChI | InChI=1S/C15H20O5/c1-8-14-12(6-11(17-4)7-13(14)18-5)15(9(2)19-8)20-10(3)16/h6-9,15H,1-5H3/t8-,9+,15+/m0/s1 |
| InChIKey | CNKGFZJJYTZVCE-IQMYEBEASA-N |
| Molecular Weight | 280.320 g/mol |
| SMILES | c12c([C@](C)(O[C@@]([C@]2(OC(=O)C)[H])(C)[H])[H])c(OC)cc(c1)OC |
| SPLASH | splash10-0a4i-0190000000-3300f4d66099ce7ce1bc |
| Source of Spectrum | KC-0-2245-21 |
| Synonyms | (1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydro-1H-2-benzopyran-4-yl acetate Acetic acid[(1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydro-1H-2-benzopyran-4-yl]ester Acetic acid[(1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-isochroman-4-yl]ester [(1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydro-1H-isochromen-4-yl]acetate [(1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydro-1H-isochromen-4-yl]ethanoate [(1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-isochroman-4-yl]acetate Acetic acid [(1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydro-1H-2-benzopyran-4-yl] ester [(1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydro-1H-isochromen-4-yl] acetate [(1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-isochroman-4-yl] acetate [(1S,3R,4S)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydro-1H-isochromen-4-yl] ethanoate |
| Wiley ID | 786304 |