![8,9-Dihydro-2H,7H-indeno[5,6-b]-(1,4)-dioxepin-3(4H)-one](/api/spectrum/LQDeFjbnpI7/structure.png?h=300&w=458 "8,9-Dihydro-2H,7H-indeno[5,6-b]-(1,4)-dioxepin-3(4H)-one")
| SpectraBase Compound ID | BcB4q12zHh |
|---|---|
| InChI | InChI=1S/C12H12O3/c13-10-6-14-11-4-8-2-1-3-9(8)5-12(11)15-7-10/h4-5H,1-3,6-7H2 |
| InChIKey | JTAHMTWJNXDJEG-UHFFFAOYSA-N |
| Mol Weight | 204.22 g/mol |
| Molecular Formula | C12H12O3 |
| Exact Mass | 204.078644 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LQDeFjbnpI7 |
|---|---|
| Name | 8,9-Dihydro-2H,7H-indeno[5,6-b]-(1,4)-dioxepin-3(4H)-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O3 |
| InChI | InChI=1S/C12H12O3/c13-10-6-14-11-4-8-2-1-3-9(8)5-12(11)15-7-10/h4-5H,1-3,6-7H2 |
| InChIKey | JTAHMTWJNXDJEG-UHFFFAOYSA-N |
| Molecular Weight | 204.225 g/mol |
| SMILES | c12c(OCC(CO2)=O)cc2c(c1)CCC2 |
| SPLASH | splash10-0udl-8940000000-8fa8fe7bd9e13477e580 |
| Source of Spectrum | H-90-1261-9 |
| Wiley ID | 1590737 |