| SpectraBase Compound ID | 8zF1eXYNNXV |
|---|---|
| InChI | InChI=1S/C18H28O6/c1-11(15(20)21-5)13-6-7-16(3)10-23-17(4)14(9-22-12(2)19)24-18(16,17)8-13/h11,13-14H,6-10H2,1-5H3/t11-,13+,14+,16-,17+,18+/m0/s1 |
| InChIKey | BSHBDBOOJXIMST-ILGLWPRSSA-N |
| Mol Weight | 340.42 g/mol |
| Molecular Formula | C18H28O6 |
| Exact Mass | 340.188589 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9wsDjlleAGU |
|---|---|
| Name | Methyl (3R,4R,5R,11S)-2-Acetoxy-1,4:3,5-diepoxy-1,2-secoeudesman-13-oate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H28O6 |
| InChI | InChI=1S/C18H28O6/c1-11(15(20)21-5)13-6-7-16(3)10-23-17(4)14(9-22-12(2)19)24-18(16,17)8-13/h11,13-14H,6-10H2,1-5H3/t11-,13+,14+,16-,17+,18+/m0/s1 |
| InChIKey | BSHBDBOOJXIMST-ILGLWPRSSA-N |
| Molecular Weight | 340.416 g/mol |
| SMILES | [C@@]123[C@@](OC[C@@]3(CC[C@](C1)([C@@](C(=O)OC)(C)[H])[H])C)(C)[C@](O2)(COC(=O)C)[H] |
| SPLASH | splash10-00dr-0090000000-fed6a461f941e4479466 |
| Source of Spectrum | F-68-4428-13 |
| Synonyms | (2S)-2-[(2R,2aR,4aS,7R,8aR)-2-(acetyloxymethyl)-2a,4a-dimethyl-2,4,5,6,7,8-hexahydrooxeto[2,3-i]isobenzofuran-7-yl]propanoic acid methyl ester Methyl (2S)-2-[(2R,2aR,4aS,7R,8aR)-2-(acetoxymethyl)-2a,4a-dimethyl-2,4,5,6,7,8-hexahydrooxeto[2,3-i]isobenzofuran-7-yl]propanoate Methyl (2S)-2-[(2R,2aR,4aS,7R,8aR)-2-(acetyloxymethyl)-2a,4a-dimethyl-2,4,5,6,7,8-hexahydrooxeto[2,3-i][2]benzofuran-7-yl]propanoate |
| Wiley ID | 1572602 |