![(1S,3S)-1,3-dimethyl-7,9-bis(oxidanyl)-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione](/api/spectrum/porUs7PMeY/structure.png?h=300&w=458 "(1S,3S)-1,3-dimethyl-7,9-bis(oxidanyl)-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione")
| SpectraBase Compound ID | 4CVti1ELAci |
|---|---|
| InChI | InChI=1S/C15H14O5/c1-6-3-9-12(7(2)20-6)15(19)13-10(14(9)18)4-8(16)5-11(13)17/h4-7,16-17H,3H2,1-2H3/t6-,7-/m0/s1 |
| InChIKey | LAAPOANQZFTHPE-BQBZGAKWSA-N |
| Mol Weight | 274.27 g/mol |
| Molecular Formula | C15H14O5 |
| Exact Mass | 274.084124 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | porUs7PMeY |
|---|---|
| Name | (1S,3S)-1,3-dimethyl-7,9-bis(oxidanyl)-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione |
| CAS Registry Number | 119182-19-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H14O5 |
| InChI | InChI=1S/C15H14O5/c1-6-3-9-12(7(2)20-6)15(19)13-10(14(9)18)4-8(16)5-11(13)17/h4-7,16-17H,3H2,1-2H3/t6-,7-/m0/s1 |
| InChIKey | LAAPOANQZFTHPE-BQBZGAKWSA-N |
| Molecular Weight | 274.272 g/mol |
| SMILES | Oc1cc2C(C3=C(C(c2c(c1)O)=O)[C@@](O[C@](C3)(C)[H])(C)[H])=O |
| SPLASH | splash10-0ldi-9000000000-9b0dc74f2765d92c3b43 |
| Source of Spectrum | F5-4-3317-30 |
| Synonyms | (1S,3S)-7,9-dihydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g]isochromene-5,10-dione ent-deoxyquinone - A (1S,3S)-7,9-dihydroxy-1,3-dimethyl-3,4-dihydro-1H-benzo[g][2]benzopyran-5,10-dione (1S,3S)-7,9-dihydroxy-1,3-dimethyl-3,4-dihydro-1H-benz[g]isochromene-5,10-quinone (1S,3S)-7,9-Dihydroxy-1,3-dimethyl-3,4,5,10-tetrahydro-1H-naphtho[2,3-c]pyran-5,10-dione |
| Wiley ID | 1732976 |