![Diethyl 1,3,3a,3b,8,8a-hexahydrocyclopenta[c]isobenzofuran-1,3-dione-5,5-dicarboxylate](/api/spectrum/3u8qkYNHqPy/structure.png?h=300&w=458 "Diethyl 1,3,3a,3b,8,8a-hexahydrocyclopenta[c]isobenzofuran-1,3-dione-5,5-dicarboxylate")
| SpectraBase Compound ID | EVelbsP5agB |
|---|---|
| InChI | InChI=1S/C17H20O7/c1-3-22-15(20)17(16(21)23-4-2)7-9-5-6-10-12(11(9)8-17)14(19)24-13(10)18/h5,10-12H,3-4,6-8H2,1-2H3/t10-,11+,12-/m0/s1 |
| InChIKey | FBNNGUDZXWIBMO-TUAOUCFPSA-N |
| Mol Weight | 336.34 g/mol |
| Molecular Formula | C17H20O7 |
| Exact Mass | 336.120903 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3u8qkYNHqPy |
|---|---|
| Name | Diethyl 1,3,3a,3b,8,8a-hexahydrocyclopenta[c]isobenzofuran-1,3-dione-5,5-dicarboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H20O7 |
| InChI | InChI=1S/C17H20O7/c1-3-22-15(20)17(16(21)23-4-2)7-9-5-6-10-12(11(9)8-17)14(19)24-13(10)18/h5,10-12H,3-4,6-8H2,1-2H3/t10-,11+,12-/m0/s1 |
| InChIKey | FBNNGUDZXWIBMO-TUAOUCFPSA-N |
| Molecular Weight | 336.340 g/mol |
| SMILES | C1(C[C@]2([C@]3(C(OC([C@]3(CC=C2C1)[H])=O)=O)[H])[H])(C(=O)OCC)C(=O)OCC |
| SPLASH | splash10-014l-1970000000-04cb61394b5e71e4270f |
| Source of Spectrum | SO-0-1770-4 |
| Synonyms | (3aR,3bS,8aS)-Diethyl 1,3,3a,3b,8,8a-hexahydrocyclopenta[c]isobenzofuran-1,3-dione-5,5-dicarboxylate (3aS,8aS,8bR)-1,3-dioxo-3a,4,6,8,8a,8b-hexahydrocyclopenta[e]isobenzofuran-7,7-dicarboxylic acid diethyl ester Diethyl (3aS,8aS,8bR)-1,3-dioxo-3a,4,6,8,8a,8b-hexahydrocyclopenta[e][2]benzofuran-7,7-dicarboxylate Diethyl (3aS,8aS,8bR)-1,3-dioxo-3a,4,6,8,8a,8b-hexahydrocyclopenta[e]isobenzofuran-7,7-dicarboxylate Diethyl (3aS,8aS,8bR)-1,3-bis(oxidanylidene)-3a,4,6,8,8a,8b-hexahydrocyclopenta[e][2]benzofuran-7,7-dicarboxylate |
| Wiley ID | 878243 |