| SpectraBase Compound ID | HyqcWL1vHDi |
|---|---|
| InChI | InChI=1S/C14H18O2/c1-14(2,3)13(16)10-9-12(15)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3 |
| InChIKey | IZBIILHAJJUBNU-UHFFFAOYSA-N |
| Mol Weight | 218.3 g/mol |
| Molecular Formula | C14H18O2 |
| Exact Mass | 218.13068 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | A2MsjJwCgyW |
|---|---|
| Name | 5,5-Dimethyl-1-phenyl-hexane-1,4-dione |
| CAS Registry Number | 56079-45-9 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H18O2 |
| InChI | InChI=1S/C14H18O2/c1-14(2,3)13(16)10-9-12(15)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3 |
| InChIKey | IZBIILHAJJUBNU-UHFFFAOYSA-N |
| Molecular Weight | 218.296 g/mol |
| SMILES | C(C(C)(C)C)(CCC(=O)c1ccccc1)=O |
| SPLASH | splash10-0a4i-7900000000-c1512c9b76306dbe17d9 |
| Source of Spectrum | J-55-1085-0 |
| Wiley ID | 1218002 |