| SpectraBase Compound ID | 42D5ijQ8zea |
|---|---|
| InChI | InChI=1S/C12H14O3/c1-10(13)7-8-11(14)9-15-12-5-3-2-4-6-12/h2-6H,7-9H2,1H3 |
| InChIKey | MBPFZYQVJZRSOS-UHFFFAOYSA-N |
| Mol Weight | 206.24 g/mol |
| Molecular Formula | C12H14O3 |
| Exact Mass | 206.094294 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 | 1HqzFXHcq0 |
|---|---|
| Name | 1-Phenoxyhexane-2,5-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H14O3 |
| InChI | InChI=1S/C12H14O3/c1-10(13)7-8-11(14)9-15-12-5-3-2-4-6-12/h2-6H,7-9H2,1H3 |
| InChIKey | MBPFZYQVJZRSOS-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/adsc.201100800 |
| Molecular Weight | 206.241 g/mol |
| SMILES | C(Oc1ccccc1)C(=O)CCC(=O)C |
| SPLASH | splash10-0005-9000000000-b2b03555ef5c0945072f |
| Source of Spectrum | ASC-354-863/SM12-11d |
| Wiley ID | 1762964 |