| SpectraBase Compound ID | HGtUKEqDq9D |
|---|---|
| InChI | InChI=1S/C31H22O9/c1-39-28(37)30-11-15-9-19-20(24(33)8-7-23(19)32)10-16(15)12-31(27(30)36,29(38)40-2)14-22-21(13-30)25(34)17-5-3-4-6-18(17)26(22)35/h3-10H,11-14H2,1-2H3 |
| InChIKey | KRIYNYXDVJUXEF-UHFFFAOYSA-N |
| Mol Weight | 538.51 g/mol |
| Molecular Formula | C31H22O9 |
| Exact Mass | 538.126382 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IJIbhBsbJg3 |
|---|---|
| Name | Dimethyl 1,4,9,14,19-pentaoxo-1,4,6,7,8,9,14,15,16,17-decahydro-7,16-methanodinaphtho(2,3-a:2',3'-f)cyclodecene-7,16-dicarboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C31H22O9 |
| InChI | InChI=1S/C31H22O9/c1-39-28(37)30-11-15-9-19-20(24(33)8-7-23(19)32)10-16(15)12-31(27(30)36,29(38)40-2)14-22-21(13-30)25(34)17-5-3-4-6-18(17)26(22)35/h3-10H,11-14H2,1-2H3 |
| InChIKey | KRIYNYXDVJUXEF-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 538.508 g/mol |
| SMILES | c12c(CC3(CC4=C(CC(C2)(C3=O)C(=O)OC)C(c2ccccc2C4=O)=O)C(=O)OC)cc2C(C=CC(c2c1)=O)=O |
| SPLASH | splash10-000i-0013090000-c8bb57bb46d4ee1f5c45 |
| Source of Spectrum | SRH-2022-11527-0 |
| Wiley ID | 1833109 |