| SpectraBase Compound ID | BVl1rZsIKWA |
|---|---|
| InChI | InChI=1S/C12H12O2/c1-2-11(13)12(14)9-8-10-6-4-3-5-7-10/h2-7H,1,8-9H2 |
| InChIKey | VXIIKGXQYRFTOK-UHFFFAOYSA-N |
| Mol Weight | 188.23 g/mol |
| Molecular Formula | C12H12O2 |
| Exact Mass | 188.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8Gbryi0uDn6 |
|---|---|
| Name | 1-Phenyl-5-hexene-3,4-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H12O2 |
| InChI | InChI=1S/C12H12O2/c1-2-11(13)12(14)9-8-10-6-4-3-5-7-10/h2-7H,1,8-9H2 |
| InChIKey | VXIIKGXQYRFTOK-UHFFFAOYSA-N |
| Molecular Weight | 188.226 g/mol |
| SMILES | C(CC(C(C=C)=O)=O)c1ccccc1 |
| SPLASH | splash10-0a4i-9000000000-238442e5d7a2876d93ac |
| Source of Spectrum | Y1-45-4059-3 |
| Synonyms | 6-Phenyl-1-hexene-3,4-dione |
| Wiley ID | 1621989 |