| SpectraBase Compound ID | DWkCtwFXgYF |
|---|---|
| InChI | InChI=1S/C12H14O2/c1-2-3-9-11(13)12(14)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3 |
| InChIKey | SFNCJWNDARNDSM-UHFFFAOYSA-N |
| Mol Weight | 190.24 g/mol |
| Molecular Formula | C12H14O2 |
| Exact Mass | 190.09938 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BtaP4AiaTjW |
|---|---|
| Name | 1-Phenylhexane-1,2-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H14O2 |
| InChI | InChI=1S/C12H14O2/c1-2-3-9-11(13)12(14)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3 |
| InChIKey | SFNCJWNDARNDSM-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/jo201029p |
| Molecular Weight | 190.242 g/mol |
| SMILES | c1c(cccc1)C(C(CCCC)=O)=O |
| SPLASH | splash10-0a4i-9700000000-d75ae6631418e004ce95 |
| Source of Spectrum | J-76-6961-2p |
| Wiley ID | 1746779 |