| SpectraBase Compound ID | 3tuOV1yWDCh |
|---|---|
| InChI | InChI=1S/C16H22O/c1-13(12-15(17)16(2,3)4)10-11-14-8-6-5-7-9-14/h5-11,13H,12H2,1-4H3 |
| InChIKey | CYUPWTINRIUBOR-UHFFFAOYSA-N |
| Mol Weight | 230.35 g/mol |
| Molecular Formula | C16H22O |
| Exact Mass | 230.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CzESkc0iXEH |
|---|---|
| Name | 2,2,5-Trimethyl-7-phenyl-6-hepten-3-one isomer |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H22O |
| InChI | InChI=1S/C16H22O/c1-13(12-15(17)16(2,3)4)10-11-14-8-6-5-7-9-14/h5-11,13H,12H2,1-4H3 |
| InChIKey | CYUPWTINRIUBOR-UHFFFAOYSA-N |
| Molecular Weight | 230.351 g/mol |
| SMILES | C(C(C)(C)C)(CC(C=Cc1ccccc1)C)=O |
| SPLASH | splash10-0a59-9600000000-14b8382d3f264f99d453 |
| Source of Spectrum | AJ-66-855-24 |
| Wiley ID | 771880 |