![9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-[2]benzofuro[5,6-f][1,3]benzodioxole-5,8-dione](/api/spectrum/HICTIGFuCnC/structure.png?h=300&w=458 "9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-[2]benzofuro[5,6-f][1,3]benzodioxole-5,8-dione")
| SpectraBase Compound ID | 1GtEo3qVcMY |
|---|---|
| InChI | InChI=1S/C22H20O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-19H,8-9H2,1-3H3 |
| InChIKey | ISCQYPPCSYRZOT-UHFFFAOYSA-N |
| Mol Weight | 412.39 g/mol |
| Molecular Formula | C22H20O8 |
| Exact Mass | 412.115818 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HICTIGFuCnC |
|---|---|
| Name | 9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-[2]benzofuro[5,6-f][1,3]benzodioxole-5,8-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H20O8 |
| InChI | InChI=1S/C22H20O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-19H,8-9H2,1-3H3 |
| InChIKey | ISCQYPPCSYRZOT-UHFFFAOYSA-N |
| Molecular Weight | 412.394 g/mol |
| SMILES | C12C(C(c3cc(OC)c(c(c3)OC)OC)c3c(C1=O)cc1c(OCO1)c3)C(=O)OC2 |
| SPLASH | splash10-03xr-0105900000-ccedf9f04d85fda5eed2 |
| Source of Spectrum | B6-0-0-0 |
| Synonyms | 9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxole-5,8-dione 9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydroisobenzofuro[5,6-f][1,3]benzodioxole-5,8-dione 9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydroisobenzofuro[5,6-f][1,3]benzodioxole-5,8-quinone |
| Wiley ID | 1374381 |