| SpectraBase Compound ID | 1gmmqAXjSBJ |
|---|---|
| InChI | InChI=1S/C13H14O3/c14-13-8-10-15-12(7-4-9-16-13)11-5-2-1-3-6-11/h1-7,12H,8-10H2/b7-4- |
| InChIKey | PRPHKYUEXROJNE-DAXSKMNVSA-N |
| Mol Weight | 218.25 g/mol |
| Molecular Formula | C13H14O3 |
| Exact Mass | 218.094294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ILIRdHwtdw4 |
|---|---|
| Name | (7Z)-9-phenyl-2,3,6,9-tetrahydro-1,5-dioxonin-4-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H14O3 |
| InChI | InChI=1S/C13H14O3/c14-13-8-10-15-12(7-4-9-16-13)11-5-2-1-3-6-11/h1-7,12H,8-10H2/b7-4- |
| InChIKey | PRPHKYUEXROJNE-DAXSKMNVSA-N |
| Molecular Weight | 218.252 g/mol |
| SMILES | C1(OC\C=C/C(OCC1)c1ccccc1)=O |
| SPLASH | splash10-052e-4900000000-75e4da241f9c6250b2fa |
| Source of Spectrum | KC-0-1783-17 |
| Wiley ID | 825487 |